data_1b2i_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 1b2i _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.58 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.45 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.511 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.58 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.405 ' CG2' ' HE1' ' A' ' 2' ' ' MET . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.411 ' OD2' ' NZ ' ' A' ' 70' ' ' LYS . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.411 ' NZ ' ' OD2' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.485 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.485 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.505 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.505 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.527 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.55 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.55 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.563 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.563 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.447 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.447 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.615 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.615 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.444 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.441 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.444 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.441 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.504 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.416 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.513 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.416 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.504 HH12 ' CD ' ' A' ' 7' ' ' GLU 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p . . . . . 0 C--O 1.225 -0.189 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.532 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.402 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.426 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.532 ' HZ3' ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.426 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER . . . . . 0 C--O 1.225 -0.224 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.442 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.443 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.442 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.573 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HB3' ' HZ1' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.486 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.476 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.453 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.476 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.573 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.51 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.486 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p . . . . . 0 N--CA 1.464 0.233 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.455 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.415 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.615 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.615 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p . . . . . 0 C--O 1.225 -0.207 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.619 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.502 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.502 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.619 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.511 ' HZ2' ' HB2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.472 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.463 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.618 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.618 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.456 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.59 ' CG ' ' HZ1' ' A' ' 12' ' ' LYS . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.59 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.432 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.409 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.409 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.432 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.401 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 5.5 m120 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.401 ' NZ ' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.456 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.468 0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.476 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.423 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.476 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.417 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.417 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p . . . . . 0 C--O 1.222 -0.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.465 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.465 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.225 -0.218 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.444 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.568 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.431 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.431 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.568 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.411 ' HZ1' ' HB3' ' A' ' 12' ' ' LYS . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.514 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.41 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.41 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 12' ' ' LYS . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.432 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.432 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.602 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.602 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.469 0.504 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.404 ' CD ' ' H ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.404 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.441 ' H3 ' ' CD ' ' A' ' -1' ' ' GLU . 5.0 t . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 p -166.4 -64.63 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.007 -1.451 . . . . 0.0 107.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -142.97 121.7 12.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 112.13 -2.305 . . . . 0.0 105.228 175.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.441 ' CD ' ' H3 ' ' A' ' -4' ' ' THR . 6.0 mm-40 -98.39 -23.13 15.72 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.756 -174.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p -125.7 143.76 50.9 Favored 'General case' 0 C--N 1.353 0.735 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 173.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.58 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.45 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.511 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.47 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.511 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.58 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.47 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.612 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.656 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.435 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.625 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.405 ' CG2' ' HE1' ' A' ' 2' ' ' MET . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.656 ' H71' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.628 ' H1 ' ' CD ' ' A' ' -2' ' ' GLU . 1.5 p . . . . . 0 N--CA 1.443 -0.788 0 CA-C-O 121.42 0.628 . . . . 0.0 110.209 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 1.5 m -74.72 -37.05 62.65 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.151 -1.386 . . . . 0.0 112.322 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . 0.628 ' CD ' ' H1 ' ' A' ' -4' ' ' THR . 0.2 OUTLIER 62.06 63.83 1.05 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 111.911 -2.404 . . . . 0.0 110.242 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.44 45.13 0.29 Allowed 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.871 -177.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p -169.43 135.36 1.58 Allowed 'General case' 0 C--N 1.344 0.348 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 172.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.596 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.691 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.413 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.411 ' OD2' ' NZ ' ' A' ' 70' ' ' LYS . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.411 ' NZ ' ' OD2' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.536 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.415 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.485 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.485 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.691 ' H71' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.541 ' H3 ' ' CD ' ' A' ' -1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.1 t -166.52 132.56 2.37 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.229 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . 0.511 ' CD ' ' HZ2' ' A' ' 12' ' ' LYS . 0.5 OUTLIER 52.19 35.17 16.02 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.833 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.541 ' CD ' ' H3 ' ' A' ' -4' ' ' THR . 9.0 pt-20 -121.01 27.44 8.46 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -173.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p -161.15 137.17 8.17 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 172.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.505 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.511 ' HZ2' ' CD ' ' A' ' -2' ' ' GLU . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.505 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.48 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.527 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.682 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.579 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.55 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.6 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.55 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.682 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.557 ' H3 ' ' CD ' ' A' ' -1' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 N-CA-C 103.212 -2.885 . . . . 0.0 103.212 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 m 60.79 81.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.644 0 O-C-N 126.335 2.272 . . . . 0.0 113.482 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 40.96 49.5 2.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 113.866 -1.516 . . . . 0.0 112.6 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.557 ' CD ' ' H3 ' ' A' ' -4' ' ' THR . 6.8 pt-20 -70.09 -63.54 1.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -172.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p -108.11 154.07 22.24 Favored 'General case' 0 C--N 1.347 0.472 0 O-C-N 124.153 0.908 . . . . 0.0 109.738 -176.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.563 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.563 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.726 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.434 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.432 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.631 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.726 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.44 -0.972 0 N-CA-C 102.31 -3.219 . . . . 0.0 102.31 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 4.5 t -139.59 160.7 39.25 Favored 'General case' 0 C--N 1.342 0.269 0 N-CA-C 103.771 -2.677 . . . . 0.0 103.771 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 51.82 42.67 30.18 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 125.29 1.618 . . . . 0.0 111.335 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -123.36 13.58 9.55 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.601 -1.636 . . . . 0.0 113.414 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p -148.86 134.18 18.44 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 171.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.447 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.447 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.611 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.68 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.468 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.615 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.64 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.615 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.68 ' H71' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.515 ' H3 ' ' CD ' ' A' ' -1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.442 -0.864 0 CA-C-O 121.577 0.703 . . . . 0.0 110.063 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.2 p -168.19 127.59 1.24 Allowed 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 113.857 -1.519 . . . . 0.0 106.926 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 50.65 44.68 27.47 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 125.093 1.495 . . . . 0.0 110.783 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.515 ' CD ' ' H3 ' ' A' ' -4' ' ' THR . 0.1 OUTLIER -99.92 -37.94 8.82 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 111.059 -2.791 . . . . 0.0 113.54 -173.057 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p -113.97 136.85 52.45 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.444 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.441 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.444 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.441 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.672 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.413 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.455 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.475 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.672 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 102.432 -3.173 . . . . 0.0 102.432 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.426 ' HG ' ' CD ' ' A' ' -2' ' ' GLU . 8.5 t 175.15 172.39 0.26 Allowed 'General case' 0 C--O 1.225 -0.19 0 O-C-N 126.949 2.656 . . . . 0.0 104.007 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . 0.426 ' CD ' ' HG ' ' A' ' -3' ' ' SER . 1.1 mp0 47.14 46.26 16.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 122.89 1.329 . . . . 0.0 110.506 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -106.8 -29.57 9.44 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 110.923 -2.853 . . . . 0.0 115.077 -170.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p -122.53 148.13 45.55 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.328 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.504 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.416 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.513 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.416 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.642 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.504 HH12 ' CD ' ' A' ' 7' ' ' GLU 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.607 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.417 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.61 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.642 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.465 ' H3 ' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.075 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.414 ' OG ' ' NZ ' ' A' ' 12' ' ' LYS . 2.6 t -70.99 112.93 7.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -168.04 -40.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 O-C-N 125.322 1.639 . . . . 0.0 107.017 -175.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.567 ' CD ' ' HZ2' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 23.9 66.67 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 110.002 -3.272 . . . . 0.0 117.883 169.224 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p -141.28 134.04 28.77 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.532 ' CD ' ' HZ3' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.465 ' CG ' ' H3 ' ' A' ' -4' ' ' THR . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.402 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.567 ' HZ2' ' CD ' ' A' ' -1' ' ' GLU . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.426 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.532 ' HZ3' ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.426 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.678 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' OE1' ' H72' ' A' ' 84' ' ' AMH . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.418 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.615 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.678 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 29.7 t -73.96 160.39 31.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 112.088 -2.324 . . . . 0.0 106.339 171.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.36 27.34 3.44 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 126.018 2.073 . . . . 0.0 108.57 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.37 70.37 2.26 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -164.47 129.04 2.65 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 168.854 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.442 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.443 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.442 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.573 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HB3' ' HZ1' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.486 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.476 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.453 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.476 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.573 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.51 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.486 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.694 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.628 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.586 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.694 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.531 ' H1 ' ' CD ' ' A' ' -2' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.915 0.864 . . . . 0.0 108.852 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -125.43 94.72 4.23 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . 0.531 ' CD ' ' H1 ' ' A' ' -4' ' ' THR . 1.2 mm-40 -78.31 120.35 22.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 113.449 -1.705 . . . . 0.0 109.522 -172.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -84.72 -46.27 11.6 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.279 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p -99.43 152.46 19.95 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -178.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.455 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.415 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.665 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.615 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.64 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.615 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.665 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.945 0 N-CA-C 103.227 -2.879 . . . . 0.0 103.227 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.9 t -76.09 -174.69 2.82 Favored 'General case' 0 C--N 1.346 0.416 0 O-C-N 125.971 2.045 . . . . 0.0 107.461 176.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 58.92 48.94 10.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 112.907 -1.951 . . . . 0.0 112.844 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.424 ' OE1' ' NZ ' ' A' ' 12' ' ' LYS . 4.0 tp10 -150.07 -64.87 0.21 Allowed 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 111.609 -2.541 . . . . 0.0 108.348 179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p -110.21 147.4 33.84 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 113.359 -1.746 . . . . 0.0 107.456 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.619 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.424 ' NZ ' ' OE1' ' A' ' -1' ' ' GLU . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.472 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.502 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.502 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.619 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.511 ' HZ2' ' HB2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.642 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.543 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.42 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.625 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.472 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.642 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 102.3 -3.222 . . . . 0.0 102.3 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.2 p -166.96 171.22 11.38 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 126.304 2.253 . . . . 0.0 105.539 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -121.95 101.2 7.41 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -74.56 -29.14 61.24 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.767 -175.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p -120.49 148.91 43.21 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.463 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.579 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.67 ' OE1' ' H71' ' A' ' 84' ' ' AMH . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.461 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.618 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.632 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.618 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.67 ' H71' ' OE1' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.402 ' O ' ' NZ ' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -53.69 119.53 5.04 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.602 1.189 . . . . 0.0 111.359 179.749 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 54.58 25.26 6.12 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 113.96 -1.473 . . . . 0.0 111.585 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -139.0 110.54 7.04 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.566 -1.652 . . . . 0.0 112.41 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p 170.51 167.64 0.07 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 109.901 -3.318 . . . . 0.0 106.119 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.456 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.59 ' CG ' ' HZ1' ' A' ' 12' ' ' LYS . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.59 ' HZ1' ' CG ' ' A' ' 10' ' ' ASP . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.432 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.409 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.409 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.432 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.639 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.584 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.401 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 5.5 m120 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.401 ' NZ ' ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.628 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.456 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.639 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.795 0 CA-C-O 121.863 0.84 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.7 m -165.88 37.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.237 -1.802 . . . . 0.0 108.228 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 45.5 47.22 11.08 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.688 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.1 -35.3 21.9 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 111.698 -2.501 . . . . 0.0 113.115 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p -112.75 143.3 44.21 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 119.844 -0.742 . . . . 0.0 109.124 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.423 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.687 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.476 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.554 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.412 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.687 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 121.258 0.551 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.442 ' O ' ' NZ ' ' A' ' 12' ' ' LYS . 95.3 p -48.76 96.27 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.015 -1.448 . . . . 0.0 114.319 -178.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 62.55 27.73 16.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.153 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.22 -6.79 25.52 Favored 'General case' 0 C--N 1.349 0.583 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.31 136.68 51.46 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 118.676 -1.209 . . . . 0.0 108.61 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.417 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' O ' ' A' ' -3' ' ' SER . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.417 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.595 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.683 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.452 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.61 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.683 ' H71' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.407 ' H ' ' CG ' ' A' ' 10' ' ' ASP . 32.1 t 72.43 63.28 0.12 Allowed 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.67 1.231 . . . . 0.0 109.895 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -156.31 150.4 25.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.62 -174.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -91.97 -55.24 3.53 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.051 -1.431 . . . . 0.0 114.045 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p -91.76 150.44 21.1 Favored 'General case' 0 C--N 1.346 0.44 0 O-C-N 123.975 0.797 . . . . 0.0 108.866 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' -3' ' ' SER . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.465 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.465 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.415 ' HH ' ' C8 ' ' A' ' 84' ' ' AMH . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.577 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.452 ' OE1' ' C7 ' ' A' ' 84' ' ' AMH . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.598 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.598 ' C8 ' HH12 ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.484 ' H2 ' ' CD ' ' A' ' -1' ' ' GLU . 3.1 m . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 102.992 -2.966 . . . . 0.0 102.992 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -44.04 119.21 1.68 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 125.392 1.683 . . . . 0.0 113.576 -177.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 40.36 53.22 2.93 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 113.233 -1.803 . . . . 0.0 112.898 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.484 ' CD ' ' H2 ' ' A' ' -4' ' ' THR . 0.4 OUTLIER -73.91 30.83 0.08 Allowed 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 -173.23 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p -166.88 137.6 3.18 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 173.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.444 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.568 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.431 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.431 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.568 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.646 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.529 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . 0.407 ' CZ2' ' H62' ' A' ' 84' ' ' AMH . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.483 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.421 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.646 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . 0.27 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 102.213 -3.254 . . . . 0.0 102.213 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 3.9 m -162.44 125.51 2.91 Favored 'General case' 0 C--N 1.345 0.386 0 O-C-N 124.387 1.054 . . . . 0.0 109.34 -179.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 55.31 36.47 27.12 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.622 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -99.01 0.07 43.09 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.171 -1.377 . . . . 0.0 114.462 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p -125.22 124.28 41.36 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.411 ' HZ1' ' HB3' ' A' ' 12' ' ' LYS . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.514 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.41 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.41 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.514 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.675 ' OD2' ' H72' ' A' ' 84' ' ' AMH . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.558 ' OE2' ' H71' ' A' ' 84' ' ' AMH . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.526 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.408 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.675 ' H72' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' THR . . . . . 0.517 ' H3 ' ' CD ' ' A' ' -1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.525 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.52 -40.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 109.592 -3.458 . . . . 0.0 112.331 -161.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . 0.504 ' CD ' ' HZ2' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -144.27 12.73 1.58 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 124.352 1.032 . . . . 0.0 113.223 -173.652 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . 0.517 ' CD ' ' H3 ' ' A' ' -4' ' ' THR . 55.9 mp0 -79.7 69.85 6.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.63 -0.828 . . . . 0.0 112.323 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p -157.65 132.71 8.76 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 171.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.511 ' CG ' ' HZ3' ' A' ' 12' ' ' LYS . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.511 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.432 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.467 ' OD2' ' NZ ' ' A' ' 48' ' ' LYS . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.432 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' NZ ' ' OD2' ' A' ' 26' ' ' ASP . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.671 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.602 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.643 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.401 ' CG ' ' H61' ' A' ' 84' ' ' AMH . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.602 ' CD ' ' HZ1' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.671 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 122.38 1.086 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' SER . . . . . 0.442 ' OG ' ' NZ ' ' A' ' 12' ' ' LYS . 5.9 t 75.4 13.36 3.08 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 112.773 -2.012 . . . . 0.0 114.023 176.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.56 135.43 57.75 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 125.314 1.634 . . . . 0.0 107.595 174.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -53.42 3.06 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 124.571 1.17 . . . . 0.0 112.918 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p -103.93 133.22 49.27 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 -178.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' OG ' ' A' ' -3' ' ' SER . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.404 ' CD ' ' H ' ' A' ' 29' ' ' SER . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.404 ' H ' ' CD ' ' A' ' 28' ' ' GLN . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.766 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.495 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.557 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' AMH . . . . . 0.766 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.582 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.543 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.543 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.582 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.479 ' HG2' HG13 ' A' ' 77' ' ' ILE . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.479 HG13 ' HG2' ' A' ' 61' ' ' PRO . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.463 HG22 HG21 ' A' ' 16' ' ' THR . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.522 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.522 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.44 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.529 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.475 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HB2' ' H ' ' A' ' 49' ' ' ASN . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.442 ' H ' ' HB2' ' A' ' 48' ' ' LYS . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.572 HH11 ' HA ' ' A' ' 52' ' ' ARG . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.45 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.419 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.48 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.484 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.484 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.423 HH21 ' HA ' ' A' ' 76' ' ' ASP . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.423 ' HA ' HH21 ' A' ' 59' ' ' ARG . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.407 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.472 ' SG ' HG23 ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.416 HG22 HG21 ' A' ' 16' ' ' THR . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.549 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.549 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.426 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.404 ' CE ' HG21 ' A' ' 77' ' ' ILE . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.437 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 ' CE ' ' A' ' 2' ' ' MET . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p . . . . . 0 C--O 1.225 -0.189 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' OE1' ' NZ ' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.41 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.495 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 47' ' ' LYS 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER . . . . . 0 C--O 1.225 -0.224 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.443 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.499 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.479 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.479 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.46 ' HG2' HG13 ' A' ' 77' ' ' ILE . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.46 HG13 ' HG2' ' A' ' 61' ' ' PRO . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p . . . . . 0 N--CA 1.464 0.233 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.514 HG21 HG22 ' A' ' 65' ' ' THR . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.442 ' SG ' HG23 ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.402 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CD2' HE22 ' A' ' 23' ' ' GLN . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.436 ' HB3' HD23 ' A' ' 74' ' ' LEU . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.514 HG22 HG21 ' A' ' 16' ' ' THR . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.56 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 62' ' ' TRP . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p . . . . . 0 C--O 1.225 -0.207 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.401 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.422 ' OD2' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.523 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.523 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.461 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.443 HG22 ' SG ' ' A' ' 22' ' ' CYS . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.443 ' SG ' HG22 ' A' ' 16' ' ' THR . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.407 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.523 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' TRP . . . . . 0.411 ' HB3' HD23 ' A' ' 74' ' ' LEU . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.433 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.546 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' A' ' 62' ' ' TRP . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.437 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.42 ' HB2' ' OG ' ' A' ' 14' ' ' SER . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' ' HD2' ' A' ' 42' ' ' PRO . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 41' ' ' PHE . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.583 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.437 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.468 0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.412 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 15' ' ' LYS . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.425 ' H ' HG22 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 47' ' ' LYS 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p . . . . . 0 C--O 1.222 -0.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.467 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.225 -0.218 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.435 ' CG ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.432 HG21 HG22 ' A' ' 65' ' ' THR . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.432 HG22 HG21 ' A' ' 16' ' ' THR . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.499 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HD3' ' H ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.567 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.567 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.469 0.504 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.471 HG22 ' NZ ' ' A' ' 40' ' ' LYS . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' THR . . . . . 0.458 ' H2 ' ' CD ' ' A' ' -1' ' ' GLU . 5.0 t . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 p -166.4 -64.63 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.007 -1.451 . . . . 0.0 107.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -142.97 121.7 12.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 112.13 -2.305 . . . . 0.0 105.228 175.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLU . . . . . 0.458 ' CD ' ' H2 ' ' A' ' -4' ' ' THR . 6.0 mm-40 -98.39 -23.13 15.72 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.756 -174.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p -125.7 143.76 50.9 Favored 'General case' 0 C--N 1.353 0.735 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 173.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.483 ' HE3' ' CG2' ' A' ' 77' ' ' ILE . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.582 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.543 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.543 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.582 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.601 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.646 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.479 ' HG2' HG13 ' A' ' 77' ' ' ILE . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.453 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.612 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.483 ' CG2' ' HE3' ' A' ' 2' ' ' MET . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.646 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.443 -0.788 0 CA-C-O 121.42 0.628 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 1.5 m -74.72 -37.05 62.65 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.151 -1.386 . . . . 0.0 112.322 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 62.06 63.83 1.05 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 111.911 -2.404 . . . . 0.0 110.242 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.44 45.13 0.29 Allowed 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.871 -177.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p -169.43 135.36 1.58 Allowed 'General case' 0 C--N 1.344 0.348 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 172.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.584 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.687 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.423 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.463 HG22 HG21 ' A' ' 16' ' ' THR . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.4 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.436 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.522 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.522 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.687 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.1 t -166.52 132.56 2.37 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.229 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLU . . . . . 0.453 ' CD ' ' HZ3' ' A' ' 12' ' ' LYS . 0.5 OUTLIER 52.19 35.17 16.02 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.833 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -121.01 27.44 8.46 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p -161.15 137.17 8.17 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 172.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.44 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HZ3' ' CD ' ' A' ' -2' ' ' GLU . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.529 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.475 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HB2' ' H ' ' A' ' 49' ' ' ASN . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.442 ' H ' ' HB2' ' A' ' 48' ' ' LYS . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.572 HH11 ' HA ' ' A' ' 52' ' ' ARG . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.678 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.578 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.407 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.45 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.592 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.419 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.48 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.678 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 N-CA-C 103.212 -2.885 . . . . 0.0 103.212 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 m 60.79 81.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.644 0 O-C-N 126.335 2.272 . . . . 0.0 113.482 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 40.96 49.5 2.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 113.866 -1.516 . . . . 0.0 112.6 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -70.09 -63.54 1.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -172.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p -108.11 154.07 22.24 Favored 'General case' 0 C--N 1.347 0.472 0 O-C-N 124.153 0.908 . . . . 0.0 109.738 -176.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.522 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.522 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.724 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.423 HH21 ' HA ' ' A' ' 76' ' ' ASP . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.458 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.614 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.423 ' HA ' HH21 ' A' ' 59' ' ' ARG . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.724 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.44 -0.972 0 N-CA-C 102.31 -3.219 . . . . 0.0 102.31 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 4.5 t -139.59 160.7 39.25 Favored 'General case' 0 C--N 1.342 0.269 0 N-CA-C 103.771 -2.677 . . . . 0.0 103.771 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 51.82 42.67 30.18 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 125.29 1.618 . . . . 0.0 111.335 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -123.36 13.58 9.55 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.601 -1.636 . . . . 0.0 113.414 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p -148.86 134.18 18.44 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 171.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.407 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.472 ' SG ' HG23 ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.599 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.671 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.489 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.416 HG22 HG21 ' A' ' 16' ' ' THR . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.549 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.626 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.403 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.549 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.671 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.442 -0.864 0 CA-C-O 121.577 0.703 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.2 p -168.19 127.59 1.24 Allowed 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 113.857 -1.519 . . . . 0.0 106.926 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 50.65 44.68 27.47 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 125.093 1.495 . . . . 0.0 110.783 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -37.94 8.82 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 111.059 -2.791 . . . . 0.0 113.54 -173.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p -113.97 136.85 52.45 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.426 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.654 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.428 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.505 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.654 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 102.432 -3.173 . . . . 0.0 102.432 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 8.5 t 175.15 172.39 0.26 Allowed 'General case' 0 C--O 1.225 -0.19 0 O-C-N 126.949 2.656 . . . . 0.0 104.007 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 47.14 46.26 16.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 122.89 1.329 . . . . 0.0 110.506 178.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -106.8 -29.57 9.44 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 110.923 -2.853 . . . . 0.0 115.077 -170.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p -122.53 148.13 45.55 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.328 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.404 ' CE ' HG21 ' A' ' 77' ' ' ILE . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.437 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.634 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.594 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.437 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.597 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 ' CE ' ' A' ' 2' ' ' MET . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.634 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -4' ' ' THR . . . . . 0.532 ' H2 ' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.075 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 2.6 t -70.99 112.93 7.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -168.04 -40.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 O-C-N 125.322 1.639 . . . . 0.0 107.017 -175.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLU . . . . . 0.442 ' CD ' ' HZ3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 23.9 66.67 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 110.002 -3.272 . . . . 0.0 117.883 169.224 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p -141.28 134.04 28.77 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' OE1' ' NZ ' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.532 ' CG ' ' H2 ' ' A' ' -4' ' ' THR . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.41 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.495 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 47' ' ' LYS 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.682 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.538 ' OE1' ' H71' ' A' ' 84' ' ' AMH . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.441 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.602 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.682 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 29.7 t -73.96 160.39 31.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 112.088 -2.324 . . . . 0.0 106.339 171.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.36 27.34 3.44 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 126.018 2.073 . . . . 0.0 108.57 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.37 70.37 2.26 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -164.47 129.04 2.65 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 168.854 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.443 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.499 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.479 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.479 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.702 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.618 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.46 ' HG2' HG13 ' A' ' 77' ' ' ILE . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.403 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.577 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.46 HG13 ' HG2' ' A' ' 61' ' ' PRO . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.702 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.915 0.864 . . . . 0.0 108.852 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -125.43 94.72 4.23 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.31 120.35 22.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 113.449 -1.705 . . . . 0.0 109.522 -172.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -84.72 -46.27 11.6 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.279 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p -99.43 152.46 19.95 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -178.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.514 HG21 HG22 ' A' ' 65' ' ' THR . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.442 ' SG ' HG23 ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.402 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CD2' HE22 ' A' ' 23' ' ' GLN . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.64 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.436 ' HB3' HD23 ' A' ' 74' ' ' LEU . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.514 HG22 HG21 ' A' ' 16' ' ' THR . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.524 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.402 ' CD2' ' H51' ' A' ' 84' ' ' AMH . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.56 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 62' ' ' TRP . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.64 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.945 0 N-CA-C 103.227 -2.879 . . . . 0.0 103.227 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.9 t -76.09 -174.69 2.82 Favored 'General case' 0 C--N 1.346 0.416 0 O-C-N 125.971 2.045 . . . . 0.0 107.461 176.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 58.92 48.94 10.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 112.907 -1.951 . . . . 0.0 112.844 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -150.07 -64.87 0.21 Allowed 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 111.609 -2.541 . . . . 0.0 108.348 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p -110.21 147.4 33.84 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 113.359 -1.746 . . . . 0.0 107.456 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.401 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.422 ' OD2' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.523 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.523 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.634 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.442 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.612 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.634 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 102.3 -3.222 . . . . 0.0 102.3 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.2 p -166.96 171.22 11.38 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 126.304 2.253 . . . . 0.0 105.539 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -121.95 101.2 7.41 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -74.56 -29.14 61.24 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.767 -175.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p -120.49 148.91 43.21 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.461 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.443 HG22 ' SG ' ' A' ' 22' ' ' CYS . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.443 ' SG ' HG22 ' A' ' 16' ' ' THR . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.407 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.523 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.564 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.673 ' OE1' ' H72' ' A' ' 84' ' ' AMH . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.48 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.433 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.546 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.614 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' A' ' 62' ' ' TRP . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.673 ' H72' ' OE1' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.69 119.53 5.04 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.602 1.189 . . . . 0.0 111.359 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 54.58 25.26 6.12 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 113.96 -1.473 . . . . 0.0 111.585 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -139.0 110.54 7.04 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.566 -1.652 . . . . 0.0 112.41 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p 170.51 167.64 0.07 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 109.901 -3.318 . . . . 0.0 106.119 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.437 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.547 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.42 ' HB2' ' OG ' ' A' ' 14' ' ' SER . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' ' HD2' ' A' ' 42' ' ' PRO . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 41' ' ' PHE . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.627 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.583 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.567 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.495 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.437 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.627 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.795 0 CA-C-O 121.863 0.84 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.7 m -165.88 37.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.237 -1.802 . . . . 0.0 108.228 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 45.5 47.22 11.08 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.688 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.1 -35.3 21.9 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 111.698 -2.501 . . . . 0.0 113.115 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p -112.75 143.3 44.21 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 119.844 -0.742 . . . . 0.0 109.124 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.412 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.708 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.432 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.708 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 121.258 0.551 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.442 ' O ' ' NZ ' ' A' ' 12' ' ' LYS . 95.3 p -48.76 96.27 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.015 -1.448 . . . . 0.0 114.319 -178.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 62.55 27.73 16.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.153 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.22 -6.79 25.52 Favored 'General case' 0 C--N 1.349 0.583 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.31 136.68 51.46 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 118.676 -1.209 . . . . 0.0 108.61 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' O ' ' A' ' -3' ' ' SER . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 15' ' ' LYS . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.425 ' H ' HG22 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 47' ' ' LYS 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.579 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.674 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.47 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.596 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.403 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.674 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.41 ' H ' ' CG ' ' A' ' 10' ' ' ASP . 32.1 t 72.43 63.28 0.12 Allowed 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.67 1.231 . . . . 0.0 109.895 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -156.31 150.4 25.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.62 -174.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -91.97 -55.24 3.53 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.051 -1.431 . . . . 0.0 114.045 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p -91.76 150.44 21.1 Favored 'General case' 0 C--N 1.346 0.44 0 O-C-N 123.975 0.797 . . . . 0.0 108.866 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.41 ' CG ' ' H ' ' A' ' -3' ' ' SER . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.467 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.565 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.452 ' OE1' ' C7 ' ' A' ' 84' ' ' AMH . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.46 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.565 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -4' ' ' THR . . . . . 0.519 HG22 ' H ' ' A' ' -3' ' ' SER . 3.1 m . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 102.992 -2.966 . . . . 0.0 102.992 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' -4' ' ' THR . 0.4 OUTLIER -44.04 119.21 1.68 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 125.392 1.683 . . . . 0.0 113.576 -177.394 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 40.36 53.22 2.93 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 113.233 -1.803 . . . . 0.0 112.898 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.91 30.83 0.08 Allowed 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 -173.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p -166.88 137.6 3.18 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 173.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.435 ' CG ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.432 HG21 HG22 ' A' ' 65' ' ' THR . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.636 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.512 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.418 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.432 HG22 HG21 ' A' ' 16' ' ' THR . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.44 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.636 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . 0.27 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 102.213 -3.254 . . . . 0.0 102.213 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 3.9 m -162.44 125.51 2.91 Favored 'General case' 0 C--N 1.345 0.386 0 O-C-N 124.387 1.054 . . . . 0.0 109.34 -179.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 55.31 36.47 27.12 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.622 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -99.01 0.07 43.09 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.171 -1.377 . . . . 0.0 114.462 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p -125.22 124.28 41.36 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.668 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.54 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.413 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.432 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.668 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -4' ' ' THR . . . . . 0.542 ' H2 ' ' CD ' ' A' ' -1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.525 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.52 -40.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 109.592 -3.458 . . . . 0.0 112.331 -161.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.27 12.73 1.58 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 124.352 1.032 . . . . 0.0 113.223 -173.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLU . . . . . 0.542 ' CD ' ' H2 ' ' A' ' -4' ' ' THR . 55.9 mp0 -79.7 69.85 6.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.63 -0.828 . . . . 0.0 112.323 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p -157.65 132.71 8.76 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 171.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HD3' ' H ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.659 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TRP . . . . . 0.408 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.567 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.623 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.418 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.567 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.659 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 122.38 1.086 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' SER . . . . . 0.442 ' OG ' ' NZ ' ' A' ' 12' ' ' LYS . 5.9 t 75.4 13.36 3.08 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 112.773 -2.012 . . . . 0.0 114.023 176.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.56 135.43 57.75 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 125.314 1.634 . . . . 0.0 107.595 174.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -53.42 3.06 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 124.571 1.17 . . . . 0.0 112.918 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p -103.93 133.22 49.27 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 -178.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' OG ' ' A' ' -3' ' ' SER . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.471 HG22 ' NZ ' ' A' ' 40' ' ' LYS . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.774 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.495 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 84' ' ' AMH . . . . . 0.774 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.461 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.582 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.543 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.543 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.582 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.479 ' HG2' HG13 ' A' ' 77' ' ' ILE . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.479 HG13 ' HG2' ' A' ' 61' ' ' PRO . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.463 HG22 HG21 ' A' ' 16' ' ' THR . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.522 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.522 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p . . . . . 0 C--O 1.225 -0.192 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.44 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.529 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.475 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.475 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HB2' ' H ' ' A' ' 49' ' ' ASN . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.442 ' H ' ' HB2' ' A' ' 48' ' ' LYS . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.572 HH11 ' HA ' ' A' ' 52' ' ' ARG . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.45 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.419 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.48 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p . . . . . 0 C--O 1.224 -0.244 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.484 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.484 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.423 HH21 ' HA ' ' A' ' 76' ' ' ASP . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.423 ' HA ' HH21 ' A' ' 59' ' ' ARG . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.407 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.472 ' SG ' HG23 ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.416 HG22 HG21 ' A' ' 16' ' ' THR . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.549 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.549 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.426 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p . . . . . 0 N--CA 1.467 0.385 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.404 ' CE ' HG21 ' A' ' 77' ' ' ILE . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.437 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 ' CE ' ' A' ' 2' ' ' MET . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p . . . . . 0 C--O 1.225 -0.189 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' OE1' ' NZ ' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.41 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.495 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 47' ' ' LYS 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER . . . . . 0 C--O 1.225 -0.224 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.443 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.499 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.479 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.479 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.46 ' HG2' HG13 ' A' ' 77' ' ' ILE . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.46 HG13 ' HG2' ' A' ' 61' ' ' PRO . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p . . . . . 0 N--CA 1.464 0.233 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.514 HG21 HG22 ' A' ' 65' ' ' THR . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.442 ' SG ' HG23 ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.402 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CD2' HE22 ' A' ' 23' ' ' GLN . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.436 ' HB3' HD23 ' A' ' 74' ' ' LEU . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.514 HG22 HG21 ' A' ' 16' ' ' THR . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.56 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 62' ' ' TRP . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p . . . . . 0 C--O 1.225 -0.207 0 N-CA-C 107.456 -1.312 . . . . 0.0 107.456 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.401 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.422 ' OD2' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.523 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.523 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p . . . . . 0 C--O 1.225 -0.19 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.461 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.443 HG22 ' SG ' ' A' ' 22' ' ' CYS . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.443 ' SG ' HG22 ' A' ' 16' ' ' THR . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.407 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.523 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . 0.411 ' HB3' HD23 ' A' ' 74' ' ' LEU . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.433 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.546 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' A' ' 62' ' ' TRP . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.446 -0.643 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.437 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.42 ' HB2' ' OG ' ' A' ' 14' ' ' SER . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' ' HD2' ' A' ' 42' ' ' PRO . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 41' ' ' PHE . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.583 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.437 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.468 0.452 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.412 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 15' ' ' LYS . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.425 ' H ' HG22 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 47' ' ' LYS 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p . . . . . 0 C--O 1.222 -0.348 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.467 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.225 -0.218 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.435 ' CG ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.432 HG21 HG22 ' A' ' 65' ' ' THR . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.432 HG22 HG21 ' A' ' 16' ' ' THR . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.499 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HD3' ' H ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.567 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.567 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.469 0.504 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.471 HG22 ' NZ ' ' A' ' 40' ' ' LYS . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . 0.458 ' H2 ' ' CD ' ' A' ' -1' ' ' GLU . 5.0 t . . . . . 0 CA--C 1.547 0.835 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 13.3 p -166.4 -64.63 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.007 -1.451 . . . . 0.0 107.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -142.97 121.7 12.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 112.13 -2.305 . . . . 0.0 105.228 175.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . 0.458 ' CD ' ' H2 ' ' A' ' -4' ' ' THR . 6.0 mm-40 -98.39 -23.13 15.72 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.756 -174.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.467 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 14.3 p -125.7 143.76 50.9 Favored 'General case' 0 C--N 1.353 0.735 0 N-CA-C 103.818 -2.66 . . . . 0.0 103.818 173.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.483 ' HE3' ' CG2' ' A' ' 77' ' ' ILE . 1.9 mpp? -128.09 162.54 26.64 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 123.593 1.663 . . . . 0.0 110.388 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -72.36 -18.43 61.75 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 110.496 -3.047 . . . . 0.0 111.065 176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.89 -69.99 0.14 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 118.025 -2.036 . . . . 0.0 114.523 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.3 p -95.04 -7.74 38.75 Favored 'General case' 0 C--N 1.352 0.683 0 N-CA-C 115.683 1.734 . . . . 0.0 115.683 -169.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 50.58 59.15 8.15 Favored Glycine 0 CA--C 1.54 1.629 0 C-N-CA 119.908 -1.139 . . . . 0.0 114.729 176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -58.48 -57.88 10.99 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 113.027 -1.587 . . . . 0.0 109.924 178.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -83.0 -23.43 33.3 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 113.252 -1.794 . . . . 0.0 112.284 -176.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -36.29 118.47 0.54 Allowed 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 -176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.582 ' CG ' ' HZ3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -143.99 69.73 1.28 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 166.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.19 -96.6 0.24 Allowed Glycine 0 C--N 1.343 0.957 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.036 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 mmmm -160.92 -11.39 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 112.068 -2.066 . . . . 0.0 111.817 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -86.67 136.91 21.89 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 8.6 t -147.4 45.87 1.13 Allowed 'General case' 0 CA--C 1.543 0.689 0 O-C-N 125.518 1.761 . . . . 0.0 110.72 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.441 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.36 122.06 42.82 Favored 'General case' 0 C--N 1.348 0.507 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.552 -177.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.8 p -71.67 127.48 32.69 Favored 'General case' 0 C--N 1.348 0.533 0 CA-C-N 113.359 -1.746 . . . . 0.0 108.356 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.0 ptm -46.19 -30.16 1.86 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 112.024 -2.353 . . . . 0.0 114.091 -172.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.6 p -129.79 31.62 4.7 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.632 -177.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.62 -93.43 0.09 OUTLIER Glycine 0 C--N 1.356 1.68 0 C-N-CA 114.268 -3.825 . . . . 0.0 117.211 -177.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -138.09 178.75 6.89 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-O 122.712 1.244 . . . . 0.0 112.998 -165.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.2 tp10 -70.42 134.76 48.13 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 112.343 -2.208 . . . . 0.0 105.385 170.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 58.5 m -72.61 154.74 40.61 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 117.125 -1.83 . . . . 0.0 111.716 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.543 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -88.2 130.85 34.96 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 109.89 -3.323 . . . . 0.0 104.152 174.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.85 156.33 6.77 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.631 -1.168 . . . . 0.0 113.459 -175.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -69.82 -4.68 21.19 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 114.095 -1.412 . . . . 0.0 113.119 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -80.16 -143.0 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 t -133.88 122.55 23.34 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.34 -80.98 0.12 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.881 -1.963 . . . . 0.0 111.543 -172.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 p 169.87 144.63 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 103.568 -2.753 . . . . 0.0 103.568 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_exo -76.72 -9.95 29.46 Favored 'Cis proline' 0 C--N 1.363 1.324 0 N-CA-C 119.427 2.818 . . . . 0.0 119.427 10.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.66 142.47 6.55 Favored 'General case' 0 C--N 1.354 0.762 0 C-N-CA 116.442 -2.103 . . . . 0.0 112.606 -177.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.36 74.22 5.98 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 113.272 -1.786 . . . . 0.0 109.443 175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.543 ' CD2' HE22 ' A' ' 23' ' ' GLN . 15.9 p80 -72.29 -179.3 2.84 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.028 -178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -83.63 -178.97 52.08 Favored Glycine 0 CA--C 1.538 1.504 0 CA-C-N 113.446 -1.706 . . . . 0.0 110.349 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 66.93 55.56 0.72 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 122.473 1.13 . . . . 0.0 108.703 -177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 72.8 mt -94.91 122.14 61.02 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 112.446 -2.161 . . . . 0.0 108.47 -174.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -50.0 -27.32 16.25 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.873 1.716 . . . . 0.0 116.537 -177.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.99 -16.65 32.38 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.46 -1.245 . . . . 0.0 114.027 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -106.57 3.92 27.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.801 -178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -125.81 110.64 25.04 Favored Pre-proline 0 C--N 1.349 0.579 0 C-N-CA 119.849 -0.74 . . . . 0.0 111.916 -176.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -76.12 -5.23 16.07 Favored 'Trans proline' 0 C--N 1.365 1.402 0 O-C-N 122.678 0.831 . . . . 0.0 111.701 157.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -70.97 154.11 42.1 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.394 -1.275 . . . . 0.0 108.476 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.582 ' HZ3' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -90.73 61.96 4.94 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 122.622 1.201 . . . . 0.0 108.492 -179.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.28 44.2 p-10 -104.43 -96.05 0.32 Allowed 'General case' 0 C--N 1.351 0.645 0 CA-C-N 112.736 -2.029 . . . . 0.0 109.831 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.1 168.27 0.52 Allowed 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 122.883 1.325 . . . . 0.0 112.614 -174.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.08 -140.22 0.08 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 112.907 -1.951 . . . . 0.0 106.323 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -73.68 -96.55 0.01 OUTLIER 'General case' 0 C--N 1.354 0.782 0 C-N-CA 118.791 -1.164 . . . . 0.0 108.453 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 43.3 p-10 -115.97 -9.69 11.72 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.676 178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -47.29 129.06 12.62 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.809 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 3.6 m -59.45 146.6 39.6 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 113.509 -1.678 . . . . 0.0 111.752 -175.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 -135.08 -166.61 1.86 Allowed 'General case' 0 C--N 1.343 0.324 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -147.2 63.03 7.75 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.913 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -56.31 -32.16 87.23 Favored 'Trans proline' 0 C--N 1.369 1.608 0 N-CA-C 117.241 1.977 . . . . 0.0 117.241 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.601 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.4 p-10 -104.11 -1.83 26.75 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 114.226 -1.352 . . . . 0.0 110.234 177.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER 52.34 61.55 3.14 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.579 -2.1 . . . . 0.0 113.526 -178.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.646 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.5 tp10 -65.35 167.83 7.97 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 109.716 -3.402 . . . . 0.0 106.694 172.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.6 tp -55.86 -70.38 0.11 Allowed 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 121.942 0.877 . . . . 0.0 111.011 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -89.2 140.92 28.86 Favored Pre-proline 0 CA--C 1.555 1.151 0 N-CA-C 106.022 -1.844 . . . . 0.0 106.022 177.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.479 ' HG2' HG13 ' A' ' 77' ' ' ILE . 57.4 Cg_endo -66.65 142.51 64.46 Favored 'Trans proline' 0 C--N 1.364 1.39 0 N-CA-C 108.511 -1.38 . . . . 0.0 108.511 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.453 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 64.8 p-90 -129.23 175.88 8.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.315 1.055 . . . . 0.0 111.178 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -159.04 167.63 28.79 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 112.206 -2.27 . . . . 0.0 106.249 173.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -75.54 147.85 39.39 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.331 -1.304 . . . . 0.0 108.263 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.75 171.45 8.98 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.804 -1.159 . . . . 0.0 109.197 -177.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 p -88.89 -8.03 55.0 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.501 -1.681 . . . . 0.0 110.578 177.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -77.49 125.39 86.17 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 119.726 -0.79 . . . . 0.0 109.199 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -57.27 -2.94 0.66 Allowed 'Trans proline' 0 C--N 1.365 1.446 0 N-CA-C 119.378 2.799 . . . . 0.0 119.378 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -119.57 -26.2 5.81 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.694 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.8 tptm -96.9 103.22 15.13 Favored 'General case' 0 C--N 1.348 0.508 0 C-N-CA 119.206 -0.997 . . . . 0.0 108.996 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.612 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 31.0 ttt180 -61.37 -88.61 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 113.324 -1.762 . . . . 0.0 110.609 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.0 p-90 -94.93 159.79 14.88 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.941 0.876 . . . . 0.0 110.917 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -165.06 144.02 6.62 Favored 'General case' 0 C--N 1.348 0.509 0 CA-C-N 113.967 -1.469 . . . . 0.0 110.118 172.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 63.5 mt -67.25 136.16 54.51 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 111.846 -2.433 . . . . 0.0 109.363 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.595 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 84.7 m -94.13 143.55 26.28 Favored 'General case' 0 C--O 1.222 -0.365 0 O-C-N 124.556 1.16 . . . . 0.0 110.572 177.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -93.95 108.02 19.86 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 115.805 -2.358 . . . . 0.0 106.757 173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.483 ' CG2' ' HE3' ' A' ' 2' ' ' MET . 36.8 mm -109.14 135.25 20.22 Favored Pre-proline 0 CA--C 1.548 0.897 0 CA-C-N 111.408 -2.633 . . . . 0.0 108.372 -176.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.86 128.78 19.46 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.474 2.116 . . . . 0.0 114.245 -171.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -71.13 136.02 47.96 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 111.507 -2.588 . . . . 0.0 108.934 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.467 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 97.5 m -70.42 108.83 4.45 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 117.675 -1.61 . . . . 0.0 109.354 175.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.7 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.69 1.244 . . . . 0.0 108.048 178.64 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.646 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.443 -0.788 0 CA-C-O 121.42 0.628 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 1.5 m -74.72 -37.05 62.65 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 114.151 -1.386 . . . . 0.0 112.322 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 62.06 63.83 1.05 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 111.911 -2.404 . . . . 0.0 110.242 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.44 45.13 0.29 Allowed 'General case' 0 CA--C 1.555 1.17 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.871 -177.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.407 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 3.5 p -169.43 135.36 1.58 Allowed 'General case' 0 C--N 1.344 0.348 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 172.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.3 mpp? -127.17 167.62 15.79 Favored 'General case' 0 C--N 1.345 0.384 0 O-C-N 124.783 1.302 . . . . 0.0 108.741 -176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -69.22 -34.11 74.34 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 113.002 -1.908 . . . . 0.0 109.246 173.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 153.72 -15.42 0.62 Allowed Glycine 0 CA--C 1.538 1.525 0 CA-C-N 112.963 -1.926 . . . . 0.0 113.092 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -90.63 -55.65 3.49 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 122.067 0.937 . . . . 0.0 112.583 -175.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 82.02 19.7 64.61 Favored Glycine 0 CA--C 1.538 1.516 0 CA-C-N 113.868 -1.515 . . . . 0.0 112.572 -178.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -44.3 -59.67 2.28 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 113.427 -1.386 . . . . 0.0 112.317 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -96.02 -5.67 40.54 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-N 114.552 -1.204 . . . . 0.0 112.42 -176.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -64.52 109.04 1.84 Allowed 'General case' 0 C--N 1.349 0.584 0 CA-C-N 114.438 -1.256 . . . . 0.0 113.165 -176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.88 60.12 1.37 Allowed 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 107.451 -1.315 . . . . 0.0 107.451 173.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.71 -111.6 1.17 Allowed Glycine 0 C--N 1.35 1.357 0 C-N-CA 118.659 -1.734 . . . . 0.0 113.208 -174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -138.17 -8.94 1.53 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.964 1.468 . . . . 0.0 114.964 -171.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 10.4 mt -72.9 135.37 27.86 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 117.581 -1.648 . . . . 0.0 107.913 -178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.01 49.22 1.47 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.249 -1.796 . . . . 0.0 109.543 -177.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -135.23 112.55 10.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.255 -179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 41.3 p -74.82 124.08 26.18 Favored 'General case' 0 C--N 1.351 0.666 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.851 177.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -35.06 -43.1 0.19 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 129.36 3.064 . . . . 0.0 115.045 -174.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 p -115.21 -40.96 3.37 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.07 -1.423 . . . . 0.0 111.581 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 -114.37 0.03 OUTLIER Glycine 0 CA--C 1.549 2.193 0 CA-C-N 113.651 -1.613 . . . . 0.0 115.061 -176.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.5 mp -139.52 -166.48 2.07 Favored 'General case' 0 C--N 1.354 0.786 0 CA-C-O 122.067 0.937 . . . . 0.0 109.639 -172.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 40.9 tp10 -69.95 145.66 51.72 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.14 174.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 55.6 m -77.28 144.51 38.08 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 124.097 1.903 . . . . 0.0 113.072 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.84 143.51 27.68 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 109.56 -3.473 . . . . 0.0 107.336 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.78 151.78 41.24 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 114.253 -1.34 . . . . 0.0 113.82 -173.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -73.12 -18.26 61.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 116.171 1.915 . . . . 0.0 116.171 -175.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -84.2 -141.7 0.07 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 116.596 -2.041 . . . . 0.0 109.145 -178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 t -111.44 114.75 28.08 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 -178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.81 -76.11 0.21 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 113.458 -1.701 . . . . 0.0 111.387 -177.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.4 p 179.77 147.55 0.44 Allowed Pre-proline 0 C--O 1.217 -0.613 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -76.59 -11.58 28.72 Favored 'Cis proline' 0 C--N 1.364 1.361 0 N-CA-C 117.697 2.153 . . . . 0.0 117.697 12.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -166.29 162.6 17.4 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.04 77.09 3.58 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.981 -1.463 . . . . 0.0 110.347 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.59 177.31 3.02 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 112.725 -2.034 . . . . 0.0 110.243 178.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.4 177.04 54.48 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-N 113.904 -1.498 . . . . 0.0 111.368 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 64.46 58.17 1.09 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 112.952 -1.624 . . . . 0.0 111.206 179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 67.0 mt -95.86 121.57 60.74 Favored Pre-proline 0 CA--C 1.544 0.718 0 CA-C-N 112.612 -2.085 . . . . 0.0 107.112 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -53.7 -26.58 38.72 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 121.831 1.687 . . . . 0.0 115.188 -173.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.8 m -64.9 -4.87 4.97 Favored 'General case' 0 CA--C 1.555 1.157 0 CA-C-N 114.104 -1.407 . . . . 0.0 113.92 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? -112.36 4.86 17.87 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.556 0.535 . . . . 0.0 110.944 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -118.9 117.88 33.47 Favored Pre-proline 0 C--N 1.347 0.488 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.612 -175.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -73.49 -6.15 18.29 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.838 0.915 . . . . 0.0 112.026 157.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -76.01 167.82 21.17 Favored 'General case' 0 C--N 1.352 0.715 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 175.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.489 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -98.14 -6.49 31.4 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 123.837 0.711 . . . . 0.0 111.429 -178.349 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.7 p-10 -36.78 -79.85 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -174.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.92 155.9 18.75 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 118.071 -1.452 . . . . 0.0 110.868 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -137.19 -141.03 0.16 Allowed 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 112.781 -2.009 . . . . 0.0 106.655 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.51 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.237 0.961 . . . . 0.0 110.167 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -140.83 22.57 2.29 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.86 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 152.57 22.11 Favored 'General case' 0 C--N 1.345 0.406 0 CA-C-N 114.262 -1.336 . . . . 0.0 111.013 -174.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 10.6 m -59.56 130.46 46.95 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.959 -1.473 . . . . 0.0 112.609 -177.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -134.62 -171.8 2.87 Favored 'General case' 0 C--N 1.352 0.696 0 O-C-N 124.593 1.183 . . . . 0.0 109.92 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.506 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.0 m120 -136.68 57.22 15.39 Favored Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 113.567 -1.651 . . . . 0.0 110.992 -177.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -58.17 -40.35 77.24 Favored 'Trans proline' 0 C--N 1.371 1.723 0 N-CA-C 115.772 1.412 . . . . 0.0 115.772 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.584 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.8 p-10 -94.94 -2.5 50.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.073 -1.876 . . . . 0.0 110.341 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.506 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.503 0.0 OUTLIER 52.38 64.84 1.7 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 112.065 -2.334 . . . . 0.0 113.363 -175.076 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.687 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.3 tp10 -69.12 170.8 9.33 Favored 'General case' 0 N--CA 1.448 -0.538 1 CA-C-N 107.717 -4.31 . . . . 0.0 105.565 172.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.2 tp -63.36 -86.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 O-C-N 124.801 1.313 . . . . 0.0 109.533 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 28.6 ttt180 -75.35 143.09 75.83 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -61.95 140.71 86.26 Favored 'Trans proline' 0 C--N 1.364 1.388 0 C-N-CA 121.22 1.28 . . . . 0.0 109.286 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.423 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 63.6 p-90 -133.52 167.52 20.31 Favored 'General case' 0 C--N 1.347 0.473 0 CA-C-O 121.748 0.785 . . . . 0.0 110.389 -177.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -150.43 163.78 37.54 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 173.18 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -71.13 154.79 41.45 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 113.932 -1.485 . . . . 0.0 108.19 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.463 HG22 HG21 ' A' ' 16' ' ' THR . 1.3 p -102.75 173.75 6.19 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 118.97 -1.092 . . . . 0.0 108.346 178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.6 p -86.92 -3.52 59.09 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 113.802 -1.544 . . . . 0.0 112.082 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -84.68 119.74 73.19 Favored Pre-proline 0 CA--C 1.551 1.002 0 O-C-N 123.746 0.654 . . . . 0.0 109.565 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.62 -7.0 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.612 0 N-CA-C 118.421 2.431 . . . . 0.0 118.421 176.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -121.86 13.07 10.62 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.357 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.52 90.03 2.47 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.4 HH11 ' C8 ' ' A' ' 84' ' ' AMH . 0.2 OUTLIER -59.47 -83.25 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.373 -176.853 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.436 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 35.0 p-90 -102.34 161.78 13.43 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.716 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -166.61 144.87 5.3 Favored 'General case' 0 C--N 1.346 0.438 0 O-C-N 125.591 1.807 . . . . 0.0 106.767 170.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 64.7 mt -65.65 142.69 57.96 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.906 -178.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.565 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.9 m -88.07 150.56 23.31 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.963 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -90.69 82.9 5.73 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 116.372 -2.131 . . . . 0.0 107.038 175.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -84.62 139.67 38.09 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 113.057 -1.883 . . . . 0.0 107.008 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.23 128.07 9.54 Favored 'Trans proline' 0 C--N 1.362 1.265 0 C-N-CA 123.245 2.63 . . . . 0.0 110.185 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.522 ' HE ' ' CG2' ' A' ' 81' ' ' THR . 37.8 ttp180 -74.34 144.46 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.476 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.407 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 79.9 m -72.18 102.78 3.14 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 172.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.522 ' CG2' ' HE ' ' A' ' 79' ' ' ARG . 7.8 t . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 118.186 -0.912 . . . . 0.0 108.978 -177.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.687 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.1 t -166.52 132.56 2.37 Favored 'General case' 0 C--N 1.353 0.72 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.229 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . 0.453 ' CD ' ' HZ3' ' A' ' 12' ' ' LYS . 0.5 OUTLIER 52.19 35.17 16.02 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.833 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -121.01 27.44 8.46 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 -173.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.401 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 6.5 p -161.15 137.17 8.17 Favored 'General case' 0 C--N 1.344 0.336 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 172.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -129.02 171.34 12.46 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-O 123.158 1.456 . . . . 0.0 109.872 -174.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.6 m170 -73.95 -26.94 60.76 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 111.229 -2.714 . . . . 0.0 110.489 174.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.95 -41.77 0.6 Allowed Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.379 -1.282 . . . . 0.0 111.931 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 p -96.91 -51.99 4.05 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 113.456 -1.372 . . . . 0.0 111.867 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 73.87 57.37 4.92 Favored Glycine 0 CA--C 1.538 1.469 0 C-N-CA 118.616 -1.754 . . . . 0.0 112.485 177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -53.92 -48.71 69.91 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 111.971 -2.114 . . . . 0.0 112.032 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -103.99 11.71 35.06 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.349 -1.296 . . . . 0.0 111.702 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -77.47 93.08 4.07 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.656 179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.44 ' CG ' ' HZ1' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -113.18 54.83 0.72 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 104.359 -2.46 . . . . 0.0 104.359 170.172 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -77.52 -91.85 0.28 Allowed Glycine 0 C--N 1.352 1.458 0 CA-C-N 111.465 -2.607 . . . . 0.0 115.53 -171.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.453 ' HZ3' ' CD ' ' A' ' -2' ' ' GLU . 1.1 mptp? -154.15 -30.63 0.12 Allowed 'General case' 0 CA--C 1.556 1.205 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -173.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mp -73.65 131.68 34.55 Favored 'Isoleucine or valine' 0 C--N 1.356 0.854 0 C-N-CA 118.164 -1.414 . . . . 0.0 108.772 -177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.529 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.5 t -139.14 35.3 2.11 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.443 -2.162 . . . . 0.0 112.174 -177.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -115.27 122.9 47.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 9.5 p -77.34 128.46 34.34 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 113.934 -1.485 . . . . 0.0 109.182 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -40.46 -39.32 0.98 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.594 2.358 . . . . 0.0 114.866 -175.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -114.97 -53.36 2.64 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.354 -175.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.46 -106.47 0.01 OUTLIER Glycine 0 CA--C 1.546 1.981 0 CA-C-N 112.143 -2.299 . . . . 0.0 116.893 -173.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.0 mt -143.1 -168.18 2.73 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 114.294 -0.953 . . . . 0.0 108.983 -169.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 tp10 -75.26 140.8 43.43 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 106.06 -1.83 . . . . 0.0 106.06 172.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.407 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 9.0 m -76.06 153.6 36.26 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 124.369 2.033 . . . . 0.0 112.469 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.99 138.92 32.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 109.135 -3.666 . . . . 0.0 106.86 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.49 150.2 36.46 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.033 -1.439 . . . . 0.0 113.14 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -70.89 -5.56 31.56 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 113.695 -1.593 . . . . 0.0 114.218 -176.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -75.06 -129.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 119.698 -0.801 . . . . 0.0 109.354 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 t -144.36 120.75 10.96 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -147.86 -65.22 0.26 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 112.75 -2.023 . . . . 0.0 110.603 -173.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -174.32 168.31 2.06 Favored Pre-proline 0 CA--C 1.543 0.674 0 N-CA-C 103.595 -2.743 . . . . 0.0 103.595 -177.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -63.4 -17.24 5.22 Favored 'Cis proline' 0 C--N 1.368 1.591 0 O-C-N 123.607 1.319 . . . . 0.0 115.14 -9.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -168.5 170.55 9.62 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.72 79.43 2.05 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 125.152 1.532 . . . . 0.0 110.628 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.3 p80 -66.87 170.74 6.16 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 112.885 -1.961 . . . . 0.0 110.223 177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.99 179.31 50.17 Favored Glycine 0 CA--C 1.536 1.353 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.316 177.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 64.56 53.87 1.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.428 -0.886 . . . . 0.0 111.46 179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 64.6 mt -98.48 126.82 38.0 Favored Pre-proline 0 CA--C 1.541 0.609 0 CA-C-N 113.176 -1.829 . . . . 0.0 106.959 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -47.67 -25.29 5.45 Favored 'Trans proline' 0 C--N 1.368 1.6 0 N-CA-C 117.418 2.045 . . . . 0.0 117.418 -175.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -59.32 -19.25 44.92 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -105.33 7.64 33.43 Favored 'General case' 0 C--N 1.348 0.508 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.858 -178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -120.7 112.21 34.03 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.111 -176.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -72.55 -10.99 25.97 Favored 'Trans proline' 0 C--N 1.368 1.553 0 O-C-N 122.515 0.745 . . . . 0.0 111.406 161.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -80.92 157.53 25.56 Favored 'General case' 0 C--N 1.352 0.69 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 174.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.475 ' O ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -102.62 27.83 6.57 Favored 'General case' 0 C--N 1.345 0.377 0 O-C-N 123.689 0.618 . . . . 0.0 109.893 -179.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.42 -59.51 5.25 Favored 'General case' 0 C--N 1.347 0.499 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.729 -177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 166.89 14.44 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 117.056 -1.857 . . . . 0.0 109.166 179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.475 ' NZ ' ' O ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -151.27 -134.0 0.06 Allowed 'General case' 0 C--O 1.221 -0.432 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 178.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HB2' ' H ' ' A' ' 49' ' ' ASN . 13.5 mmtp -66.6 -87.18 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 124.486 1.116 . . . . 0.0 108.087 178.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.442 ' H ' ' HB2' ' A' ' 48' ' ' LYS . 30.8 p-10 -132.91 -1.37 3.34 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 114.139 -1.391 . . . . 0.0 110.299 177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.3 m-30 -49.36 136.0 16.61 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 13.2 m -63.69 131.67 48.67 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 124.457 1.098 . . . . 0.0 111.082 -178.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.572 HH11 ' HA ' ' A' ' 52' ' ' ARG . 6.0 mmm180 -125.23 -171.42 2.36 Favored 'General case' 0 C--N 1.348 0.501 0 O-C-N 124.385 1.053 . . . . 0.0 109.786 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -137.03 60.04 26.22 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-N 112.729 -2.032 . . . . 0.0 108.346 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.4 -26.41 76.7 Favored 'Trans proline' 0 C--N 1.371 1.751 0 N-CA-C 115.358 1.253 . . . . 0.0 115.358 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.678 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 5.6 p30 -118.95 18.76 13.17 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 112.088 -2.324 . . . . 0.0 109.426 178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.421 0.0 OUTLIER 33.58 81.44 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 112.155 -2.293 . . . . 0.0 113.331 -176.753 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.578 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 6.8 tp10 -79.38 -178.85 6.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 111.379 -2.646 . . . . 0.0 106.481 176.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.2 tp -60.44 -72.41 0.11 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.895 176.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.6 ttt180 -101.48 146.93 33.07 Favored Pre-proline 0 CA--C 1.551 0.993 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 177.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_endo -61.49 138.18 74.29 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 121.595 1.53 . . . . 0.0 110.972 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.407 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 65.2 p-90 -125.51 172.18 9.9 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 122.343 1.068 . . . . 0.0 110.543 -177.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.1 p -157.56 166.39 33.02 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.823 -1.99 . . . . 0.0 106.107 173.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -77.48 155.15 31.9 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.438 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.45 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -108.45 173.78 6.17 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 122.172 0.987 . . . . 0.0 108.795 -179.175 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 24.3 p -78.77 -14.3 59.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 113.279 -1.782 . . . . 0.0 111.933 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -85.38 128.94 57.35 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.239 -176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -58.06 -4.08 1.41 Allowed 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 119.236 2.745 . . . . 0.0 119.236 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -116.33 -39.5 3.37 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -86.31 79.12 9.15 Favored 'General case' 0 C--N 1.349 0.552 0 N-CA-C 106.136 -1.802 . . . . 0.0 106.136 175.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.592 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 17.0 ttt180 -54.91 -79.43 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 113.34 -1.755 . . . . 0.0 110.929 -178.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.419 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 35.3 p-90 -101.26 160.4 14.44 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.099 177.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.48 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.9 tp10 -161.02 147.95 15.13 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.769 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 70.9 mt -71.21 144.16 50.21 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 113.386 -1.734 . . . . 0.0 108.847 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.523 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.7 m -97.46 158.56 15.41 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 114.216 -1.356 . . . . 0.0 111.473 177.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -101.48 96.24 7.01 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 112.968 -1.924 . . . . 0.0 107.274 175.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -101.06 139.18 20.28 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 112.144 -2.298 . . . . 0.0 106.602 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 132.43 13.37 Favored 'Trans proline' 0 C--N 1.364 1.36 0 C-N-CA 122.762 2.308 . . . . 0.0 112.561 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.1 ttm-85 -71.2 142.35 50.64 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 112.92 -1.945 . . . . 0.0 109.221 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.401 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.8 m -69.79 104.46 2.46 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 118.151 -1.42 . . . . 0.0 108.648 172.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.545 0.758 0 CA-C-N 114.346 -1.297 . . . . 0.0 108.385 179.35 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.678 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 N-CA-C 103.212 -2.885 . . . . 0.0 103.212 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.1 m 60.79 81.17 0.19 Allowed 'General case' 0 CA--C 1.542 0.644 0 O-C-N 126.335 2.272 . . . . 0.0 113.482 176.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 40.96 49.5 2.98 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 113.866 -1.516 . . . . 0.0 112.6 176.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -70.09 -63.54 1.06 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.054 1.501 . . . . 0.0 115.054 -172.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.47 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 21.9 p -108.11 154.07 22.24 Favored 'General case' 0 C--N 1.347 0.472 0 O-C-N 124.153 0.908 . . . . 0.0 109.738 -176.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.0 mmt -135.54 161.86 34.3 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 124.647 1.217 . . . . 0.0 109.049 177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -72.99 -6.35 44.83 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 114.442 -1.254 . . . . 0.0 112.933 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 132.15 -1.91 5.03 Favored Glycine 0 C--N 1.355 1.617 0 N-CA-C 115.602 1.001 . . . . 0.0 115.602 175.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 p -95.84 -49.23 5.41 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.341 1.067 . . . . 0.0 112.258 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.05 1.05 70.43 Favored Glycine 0 CA--C 1.539 1.545 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.937 -176.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -43.57 -56.49 3.66 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.719 -0.74 . . . . 0.0 112.713 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 41.5 t30 -91.02 -8.47 48.99 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.578 -179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.97 123.45 19.47 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.104 -0.953 . . . . 0.0 112.482 -176.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.522 ' CG ' ' HZ2' ' A' ' 44' ' ' LYS . 0.4 OUTLIER -164.83 61.95 0.13 Allowed 'General case' 0 C--O 1.223 -0.312 0 O-C-N 126.925 2.641 . . . . 0.0 105.227 167.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -96.82 -99.38 1.94 Allowed Glycine 0 C--N 1.351 1.401 0 CA-C-N 112.24 -2.255 . . . . 0.0 116.441 -170.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -144.02 -8.22 0.71 Allowed 'General case' 0 C--N 1.353 0.739 0 N-CA-C 116.761 2.134 . . . . 0.0 116.761 -168.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.9 mp -96.58 139.74 18.76 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 125.477 1.736 . . . . 0.0 107.15 178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 33.48 2.0 Allowed 'General case' 0 CA--C 1.546 0.807 0 O-C-N 124.866 1.354 . . . . 0.0 110.05 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -107.79 122.3 46.47 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 118.546 -1.261 . . . . 0.0 110.053 -175.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.1 p -76.61 125.93 30.1 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-N 113.501 -1.682 . . . . 0.0 109.392 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.1 ptt? -45.68 -41.91 10.97 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 111.282 -2.69 . . . . 0.0 113.783 -172.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.9 p -115.09 22.46 13.35 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 113.973 -1.467 . . . . 0.0 111.584 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.77 -110.1 0.23 Allowed Glycine 0 C--N 1.353 1.497 0 C-N-CA 114.476 -3.726 . . . . 0.0 116.729 -176.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 10.2 mt -99.1 -167.26 1.46 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 113.331 -1.434 . . . . 0.0 112.798 -163.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -101.32 151.32 22.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 112.403 -2.181 . . . . 0.0 105.158 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 50.6 m -84.13 149.89 25.89 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 124.201 1.953 . . . . 0.0 113.494 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.61 143.26 27.05 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 109.05 -3.704 . . . . 0.0 107.343 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.38 149.69 45.26 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 114.301 -1.318 . . . . 0.0 114.089 -174.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -74.55 -4.76 38.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.183 -1.371 . . . . 0.0 114.01 -177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -76.5 -129.3 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.6 t -142.7 119.68 11.33 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 106.122 -1.807 . . . . 0.0 106.122 174.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -146.79 -67.17 0.27 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 112.76 -2.018 . . . . 0.0 110.603 -173.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.1 m -174.58 168.11 1.99 Allowed Pre-proline 0 CA--C 1.543 0.684 0 N-CA-C 103.841 -2.652 . . . . 0.0 103.841 -177.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -65.99 -15.82 7.49 Favored 'Cis proline' 0 C--N 1.366 1.478 0 O-C-N 123.607 1.32 . . . . 0.0 115.043 -9.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 35.6 t60 -165.13 163.17 20.45 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.72 79.71 1.55 Allowed 'General case' 0 CA--C 1.545 0.78 0 O-C-N 124.844 1.34 . . . . 0.0 110.975 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -69.78 172.41 7.65 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 112.976 -1.92 . . . . 0.0 110.062 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.29 -170.93 44.44 Favored Glycine 0 CA--C 1.537 1.466 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.525 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 62.77 54.82 2.22 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 122.102 0.953 . . . . 0.0 109.949 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 79.7 mt -97.99 124.9 45.95 Favored Pre-proline 0 CA--C 1.542 0.647 0 CA-C-N 112.878 -1.964 . . . . 0.0 107.692 -176.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -49.46 -25.59 10.74 Favored 'Trans proline' 0 C--N 1.369 1.613 0 N-CA-C 117.036 1.899 . . . . 0.0 117.036 -174.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.4 m -58.89 -19.25 40.5 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -105.65 8.35 33.07 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.87 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -122.48 111.33 31.68 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.954 0.784 . . . . 0.0 111.078 -176.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.05 -2.74 12.94 Favored 'Trans proline' 0 C--N 1.367 1.548 0 O-C-N 122.611 0.795 . . . . 0.0 112.569 162.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -75.02 174.36 9.46 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.673 177.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.522 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 17.3 pttp -92.11 -14.07 29.78 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.333 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.31 52.9 p-10 -34.52 -93.79 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -171.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.59 122.47 12.11 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-O 122.138 0.97 . . . . 0.0 110.495 -173.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB2' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -109.95 -142.78 0.38 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.312 -2.222 . . . . 0.0 105.915 -179.451 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -61.03 -83.45 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 O-C-N 124.507 1.129 . . . . 0.0 110.296 175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -138.42 15.86 2.76 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 113.081 -1.872 . . . . 0.0 110.603 -177.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -84.93 141.91 30.04 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.209 -176.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 2.6 m -52.22 159.85 0.88 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.415 -2.175 . . . . 0.0 113.292 -174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -150.88 175.36 12.11 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 113.015 -1.902 . . . . 0.0 108.113 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -128.19 76.42 77.96 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 109.787 -3.37 . . . . 0.0 104.607 171.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_exo -74.77 -44.07 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-O 122.258 0.857 . . . . 0.0 112.686 177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.724 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.5 p-10 -92.44 -10.72 36.94 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 112.706 -2.043 . . . . 0.0 109.506 177.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.362 0.0 OUTLIER 54.27 65.54 1.48 Allowed 'General case' 0 C--N 1.351 0.674 0 CA-C-O 124.747 2.213 . . . . 0.0 113.757 173.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 57' ' ' GLU . 3.0 pm0 -72.8 -163.93 0.15 Allowed 'General case' 0 N--CA 1.443 -0.823 1 CA-C-N 107.341 -4.481 . . . . 0.0 107.716 172.363 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -70.25 -70.51 0.29 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.536 -1.665 . . . . 0.0 111.514 178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.423 HH21 ' HA ' ' A' ' 76' ' ' ASP . 32.6 ttt180 -104.08 138.33 19.49 Favored Pre-proline 0 CA--C 1.559 1.312 0 CA-C-N 113.766 -1.561 . . . . 0.0 109.872 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -65.07 132.93 33.61 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.306 2.004 . . . . 0.0 111.901 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.458 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 68.9 p-90 -118.99 172.54 7.47 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 122.761 1.267 . . . . 0.0 111.251 179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -153.71 166.89 31.41 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 112.082 -2.326 . . . . 0.0 105.492 172.014 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -76.12 152.0 36.87 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-N 114.129 -1.396 . . . . 0.0 107.88 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.8 174.69 5.92 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-O 122.088 0.946 . . . . 0.0 109.066 -178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.7 p -81.43 -14.08 57.49 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 113.285 -1.78 . . . . 0.0 112.055 178.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.07 136.84 46.65 Favored Pre-proline 0 CA--C 1.55 0.95 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.071 -176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -72.25 0.1 7.85 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 121.627 1.551 . . . . 0.0 116.068 -176.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -119.08 -37.4 3.21 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -86.29 88.16 7.57 Favored 'General case' 0 C--N 1.347 0.46 0 C-N-CA 118.529 -1.268 . . . . 0.0 107.861 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.614 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 36.5 ttt180 -53.12 -82.86 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 113.002 -1.908 . . . . 0.0 111.433 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 42.7 p-90 -101.76 164.67 11.61 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.645 -177.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -167.26 144.29 4.52 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.623 172.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.0 mt -70.52 130.43 41.83 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 113.098 -1.865 . . . . 0.0 109.518 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.607 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.0 m -82.93 165.25 19.88 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 114.489 -1.232 . . . . 0.0 111.582 177.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.423 ' HA ' HH21 ' A' ' 59' ' ' ARG . 10.0 t70 -111.55 114.55 27.7 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 113.127 -1.851 . . . . 0.0 106.079 172.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.3 mm -109.07 139.52 21.04 Favored Pre-proline 0 C--N 1.349 0.577 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.47 127.59 25.24 Favored 'Trans proline' 0 C--N 1.362 1.282 0 O-C-N 122.951 0.974 . . . . 0.0 109.787 173.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.2 ttt-85 -77.87 131.22 37.42 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 117.544 -1.662 . . . . 0.0 111.326 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.47 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 76.2 m -75.73 100.97 4.86 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 104.452 -2.425 . . . . 0.0 104.452 169.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 14.3 t . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 117.782 -1.104 . . . . 0.0 110.373 -175.053 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.724 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.44 -0.972 0 N-CA-C 102.31 -3.219 . . . . 0.0 102.31 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 4.5 t -139.59 160.7 39.25 Favored 'General case' 0 C--N 1.342 0.269 0 N-CA-C 103.771 -2.677 . . . . 0.0 103.771 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 51.82 42.67 30.18 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 125.29 1.618 . . . . 0.0 111.335 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -123.36 13.58 9.55 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.601 -1.636 . . . . 0.0 113.414 -174.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.466 ' C ' ' SD ' ' A' ' 2' ' ' MET . 10.4 p -148.86 134.18 18.44 Favored 'General case' 0 C--N 1.347 0.497 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 171.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.466 ' SD ' ' C ' ' A' ' 1' ' ' CYS . 2.5 mpp? -134.8 -175.22 3.83 Favored 'General case' 0 C--N 1.346 0.443 0 O-C-N 124.823 1.327 . . . . 0.0 110.093 -171.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -79.1 -36.49 40.63 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 112.663 -2.062 . . . . 0.0 110.214 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 176.13 -47.34 0.12 Allowed Glycine 0 C--N 1.35 1.36 0 C-N-CA 118.0 -2.048 . . . . 0.0 112.885 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -86.77 -69.12 0.7 Allowed 'General case' 0 C--N 1.346 0.454 0 O-C-N 125.448 1.322 . . . . 0.0 110.42 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.7 60.77 1.07 Allowed Glycine 0 C--N 1.34 0.752 0 C-N-CA 118.453 -1.832 . . . . 0.0 112.643 178.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -58.86 -28.69 66.34 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 111.573 -2.313 . . . . 0.0 111.405 177.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -113.91 11.0 17.76 Favored 'General case' 0 CA--C 1.549 0.904 0 O-C-N 124.469 1.106 . . . . 0.0 111.87 177.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.407 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 20.3 t80 -73.76 114.07 11.62 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.954 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.7 p-10 -144.05 35.42 1.24 Allowed 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.069 0.856 . . . . 0.0 110.169 176.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.91 -102.34 0.03 OUTLIER Glycine 0 C--N 1.355 1.614 0 CA-C-N 113.491 -1.686 . . . . 0.0 114.39 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -145.76 -9.7 0.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 -172.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mp -79.56 132.45 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 119.04 -1.064 . . . . 0.0 108.405 -179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.09 45.16 1.99 Allowed 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 112.397 -2.183 . . . . 0.0 108.843 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.435 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 11.5 mptt -121.88 110.76 16.27 Favored 'General case' 0 C--N 1.346 0.425 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' SG ' ' A' ' 22' ' ' CYS . 30.9 p -79.03 122.41 26.16 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 113.303 -1.771 . . . . 0.0 110.368 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.5 ptm -39.37 -40.41 0.79 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 129.632 3.173 . . . . 0.0 114.898 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.0 p -133.94 40.36 3.08 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.725 -177.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.91 -120.59 0.95 Allowed Glycine 0 CA--C 1.531 1.082 0 CA-C-N 113.103 -1.862 . . . . 0.0 111.009 -178.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.4 mp -137.56 -163.49 1.45 Allowed 'General case' 0 C--N 1.352 0.683 0 CA-C-O 121.798 0.809 . . . . 0.0 108.859 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 3.4 tp10 -72.09 142.99 49.19 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 173.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.472 ' SG ' HG23 ' A' ' 16' ' ' THR . 21.0 m -75.31 145.81 41.48 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 124.406 2.05 . . . . 0.0 111.549 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.47 136.15 35.09 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 109.362 -3.563 . . . . 0.0 105.538 177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.15 150.05 18.31 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.754 -1.112 . . . . 0.0 113.385 -174.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -69.34 -16.54 63.56 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 116.678 2.103 . . . . 0.0 116.678 -174.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.11 -144.19 0.08 Allowed 'General case' 0 C--N 1.354 0.781 0 C-N-CA 116.618 -2.033 . . . . 0.0 110.029 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.5 t -107.5 113.83 27.42 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.61 -78.87 0.21 Allowed 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 113.391 -1.731 . . . . 0.0 111.65 -176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 p 174.2 138.18 0.15 Allowed Pre-proline 0 CA--C 1.541 0.616 0 N-CA-C 107.035 -1.468 . . . . 0.0 107.035 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -78.69 -12.19 33.94 Favored 'Cis proline' 0 C--N 1.365 1.438 0 N-CA-C 119.178 2.722 . . . . 0.0 119.178 19.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 160.99 17.51 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 118.02 -1.472 . . . . 0.0 109.576 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.93 71.42 4.41 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 113.184 -1.825 . . . . 0.0 110.52 178.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.46 170.34 10.73 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 113.362 -1.744 . . . . 0.0 109.365 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -74.49 -177.01 37.19 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 119.543 -1.313 . . . . 0.0 111.825 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 65.66 49.91 1.69 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 113.876 -1.162 . . . . 0.0 110.237 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 70.1 mt -93.99 107.94 31.74 Favored Pre-proline 0 CA--C 1.552 1.053 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.942 -175.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -51.86 -25.2 20.67 Favored 'Trans proline' 0 C--N 1.371 1.76 0 N-CA-C 117.956 2.252 . . . . 0.0 117.956 -174.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.0 p -65.6 -6.61 11.57 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 118.414 -1.314 . . . . 0.0 112.986 178.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -111.27 7.07 20.97 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.035 0.934 . . . . 0.0 110.348 -177.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -119.79 115.23 33.65 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.895 -178.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.24 -12.68 36.82 Favored 'Trans proline' 0 C--N 1.367 1.535 0 CA-C-O 122.118 0.799 . . . . 0.0 111.844 163.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -70.55 -167.64 0.2 Allowed 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 113.581 -1.645 . . . . 0.0 107.457 174.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.56 37.1 0.73 Allowed 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 122.474 1.13 . . . . 0.0 108.734 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 p-10 -66.23 -60.43 2.8 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 111.866 -2.424 . . . . 0.0 110.214 178.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.12 152.41 41.2 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.21 -1.396 . . . . 0.0 108.328 179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.89 -143.98 0.32 Allowed 'General case' 0 C--N 1.348 0.502 0 CA-C-N 113.902 -1.499 . . . . 0.0 107.181 179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -65.22 -86.75 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.481 1.113 . . . . 0.0 109.319 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -134.62 14.09 3.72 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.236 177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.52 138.14 38.26 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.126 -177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 2.1 m -58.32 142.53 47.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.199 -1.364 . . . . 0.0 112.613 -175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.7 mmm180 -136.06 -169.32 2.4 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -179.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -141.73 65.27 19.89 Favored Pre-proline 0 CA--C 1.547 0.836 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.714 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -56.93 -48.41 18.52 Favored 'Trans proline' 0 C--N 1.366 1.474 0 CA-C-O 122.271 0.863 . . . . 0.0 114.285 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.599 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.7 p-10 -93.59 0.16 56.47 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 112.5 -2.136 . . . . 0.0 110.536 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.425 0.0 OUTLIER 47.06 73.99 0.17 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.287 -2.233 . . . . 0.0 114.646 -177.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.671 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 9.3 tp10 -70.15 171.68 9.29 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 109.007 -3.724 . . . . 0.0 107.134 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.19 -63.73 1.19 Allowed 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 122.467 1.127 . . . . 0.0 109.952 178.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -94.74 136.81 22.71 Favored Pre-proline 0 CA--C 1.554 1.129 0 CA-C-N 112.505 -2.134 . . . . 0.0 106.098 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -68.29 139.82 46.92 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 121.628 1.552 . . . . 0.0 108.973 -178.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.489 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 66.6 p-90 -125.73 172.64 9.64 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.534 1.159 . . . . 0.0 110.805 -175.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.51 166.77 32.52 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 112.191 -2.277 . . . . 0.0 105.139 172.18 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -74.86 147.59 40.95 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.083 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.416 HG22 HG21 ' A' ' 16' ' ' THR . 1.6 p -95.8 172.14 8.21 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 118.525 -1.27 . . . . 0.0 107.657 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.3 p -77.32 -11.33 59.82 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 113.986 -1.461 . . . . 0.0 111.444 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -87.23 124.19 68.73 Favored Pre-proline 0 CA--C 1.55 0.957 0 O-C-N 123.78 0.675 . . . . 0.0 109.444 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.34 -6.56 6.96 Favored 'Trans proline' 0 C--N 1.366 1.455 0 N-CA-C 117.929 2.242 . . . . 0.0 117.929 177.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -99.73 -45.24 5.82 Favored 'General case' 0 C--N 1.35 0.605 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 -178.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.549 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.36 75.95 7.61 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 113.751 -1.568 . . . . 0.0 107.098 178.548 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.626 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 27.5 ttt180 -45.74 -79.59 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.666 -2.061 . . . . 0.0 110.499 -179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.403 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 49.7 p-90 -98.9 152.75 19.41 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.985 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.549 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.1 tp10 -156.51 144.31 19.38 Favored 'General case' 0 C--N 1.347 0.492 0 C-N-CA 117.656 -1.617 . . . . 0.0 109.562 172.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 61.2 mt -67.61 138.77 56.67 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 111.525 -2.58 . . . . 0.0 109.485 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.445 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.6 m -102.52 137.56 40.6 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 124.079 0.952 . . . . 0.0 111.121 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -89.0 95.41 10.31 Favored 'General case' 0 C--N 1.35 0.615 0 C-N-CA 115.98 -2.288 . . . . 0.0 107.681 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 40.8 mm -95.84 135.1 23.11 Favored Pre-proline 0 CA--C 1.545 0.757 0 CA-C-N 111.238 -2.71 . . . . 0.0 107.734 -178.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.09 129.67 19.92 Favored 'Trans proline' 0 C--N 1.363 1.336 0 C-N-CA 122.351 2.034 . . . . 0.0 114.356 -172.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -74.0 149.29 41.36 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.135 -1.848 . . . . 0.0 107.453 174.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.425 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 77.6 m -70.15 89.78 0.65 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 118.625 -1.23 . . . . 0.0 109.748 175.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.545 0.756 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.707 179.637 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.671 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.442 -0.864 0 CA-C-O 121.577 0.703 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 7.2 p -168.19 127.59 1.24 Allowed 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 113.857 -1.519 . . . . 0.0 106.926 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 50.65 44.68 27.47 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 125.093 1.495 . . . . 0.0 110.783 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.92 -37.94 8.82 Favored 'General case' 0 C--N 1.353 0.73 0 CA-C-N 111.059 -2.791 . . . . 0.0 113.54 -173.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.5 p -113.97 136.85 52.45 Favored 'General case' 0 C--N 1.357 0.899 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -132.34 178.48 6.79 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -63.75 -37.95 89.3 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.34 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 166.75 -28.42 0.18 Allowed Glycine 0 C--N 1.352 1.468 0 C-N-CA 118.425 -1.845 . . . . 0.0 113.508 178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 p -69.16 -42.27 76.14 Favored 'General case' 0 C--N 1.348 0.537 0 O-C-N 124.751 0.912 . . . . 0.0 113.031 -173.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 85.88 12.7 70.98 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-N 113.289 -1.778 . . . . 0.0 113.737 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.483 ' CD ' HH21 ' A' ' 56' ' ' ARG . 11.6 tp10 -59.17 -38.03 78.78 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 117.64 -1.624 . . . . 0.0 111.062 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.76 25.24 6.04 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.582 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -88.34 115.6 25.95 Favored 'General case' 0 C--N 1.349 0.583 0 C-N-CA 119.292 -0.963 . . . . 0.0 110.071 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.328 0.0 OUTLIER -158.51 71.84 0.58 Allowed 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.595 1.184 . . . . 0.0 108.142 169.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -116.81 -116.77 2.9 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 113.263 -1.79 . . . . 0.0 110.993 -178.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -126.38 -6.85 6.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -173.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -75.08 129.35 36.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 t -145.4 44.17 1.3 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.404 -2.18 . . . . 0.0 107.91 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.03 124.93 30.27 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -178.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.2 p -81.13 137.16 35.96 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 122.984 1.373 . . . . 0.0 110.082 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 ptm -47.97 -31.74 5.65 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 110.82 -2.9 . . . . 0.0 113.47 -173.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.426 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 1.2 p -138.6 44.14 2.1 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.806 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.81 -94.89 0.1 Allowed Glycine 0 C--N 1.354 1.54 0 C-N-CA 114.244 -3.836 . . . . 0.0 117.373 178.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -143.74 178.96 7.45 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-O 122.642 1.211 . . . . 0.0 111.355 -162.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 34.2 tp10 -71.91 135.02 46.37 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 111.982 -2.372 . . . . 0.0 107.081 172.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 11.6 m -71.1 148.04 47.85 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 123.887 1.804 . . . . 0.0 111.565 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.443 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.72 133.55 36.97 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 109.672 -3.422 . . . . 0.0 105.353 176.587 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.5 154.14 21.55 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 114.223 -1.353 . . . . 0.0 113.856 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.47 -1.95 12.41 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.745 -1.116 . . . . 0.0 113.661 -178.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p30 -79.02 -138.55 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -134.84 122.72 22.44 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.08 -78.17 0.15 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 113.141 -1.845 . . . . 0.0 112.214 -170.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 173.96 145.12 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 103.701 -2.703 . . . . 0.0 103.701 -175.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -73.73 -16.48 18.84 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 119.053 2.674 . . . . 0.0 119.053 10.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.14 161.7 6.8 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 118.556 -1.257 . . . . 0.0 109.366 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.3 77.84 1.84 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 113.543 -1.662 . . . . 0.0 110.077 177.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.443 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.3 p80 -68.8 175.71 3.45 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 112.28 -2.236 . . . . 0.0 111.13 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.16 179.98 52.46 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 113.965 -1.47 . . . . 0.0 111.247 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 62.64 55.88 2.09 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.503 1.144 . . . . 0.0 109.799 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.6 mt -94.5 121.07 64.16 Favored Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 112.242 -2.254 . . . . 0.0 107.68 -176.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -48.92 -28.17 12.86 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 122.164 1.91 . . . . 0.0 116.606 -176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.3 m -60.28 -16.68 36.35 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.43 -1.259 . . . . 0.0 114.152 179.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -103.95 5.11 35.35 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-N 114.882 -1.053 . . . . 0.0 111.684 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -121.61 109.04 34.73 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.225 -177.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.43 -10.57 29.38 Favored 'Trans proline' 0 C--N 1.369 1.652 0 CA-C-O 122.278 0.866 . . . . 0.0 111.829 164.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -69.44 -165.87 0.09 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.374 -1.739 . . . . 0.0 107.161 174.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.63 43.02 1.17 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 123.277 1.513 . . . . 0.0 107.551 177.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -70.41 -64.55 0.87 Allowed 'General case' 0 C--N 1.346 0.439 0 CA-C-N 110.903 -2.862 . . . . 0.0 109.337 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.13 157.51 36.72 Favored 'General case' 0 C--N 1.348 0.54 0 C-N-CA 119.188 -1.005 . . . . 0.0 109.459 -179.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.42 -146.15 0.23 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.785 -2.007 . . . . 0.0 106.309 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -75.33 -98.94 0.02 OUTLIER 'General case' 0 C--N 1.354 0.781 0 C-N-CA 118.883 -1.127 . . . . 0.0 108.776 173.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -115.14 13.67 16.86 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.768 0.794 . . . . 0.0 111.123 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.89 130.51 36.7 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.878 -1.51 . . . . 0.0 108.066 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.618 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.0 m -53.76 155.87 3.02 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.011 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -149.76 -173.61 4.46 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.557 -179.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.454 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 7.8 m120 -132.67 56.05 20.58 Favored Pre-proline 0 CA--C 1.552 1.029 0 CA-C-N 112.643 -2.071 . . . . 0.0 110.323 -177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -52.57 -44.22 49.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 CA-C-O 123.485 1.369 . . . . 0.0 115.443 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.654 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.3 p30 -106.21 12.14 30.43 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.173 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.376 0.0 OUTLIER 32.67 69.7 0.12 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 112.356 -2.202 . . . . 0.0 115.222 -177.828 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 9.4 tp10 -64.59 166.47 8.56 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 108.579 -3.919 . . . . 0.0 107.21 172.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.2 tp -57.64 -56.16 25.54 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.425 -1.261 . . . . 0.0 111.065 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -103.16 142.58 24.86 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -64.14 134.43 42.53 Favored 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 121.56 1.507 . . . . 0.0 109.304 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.428 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 56.4 p-90 -123.75 169.83 11.12 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.807 0.813 . . . . 0.0 111.688 -175.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -156.25 166.3 33.86 Favored 'General case' 0 C--N 1.345 0.386 0 CA-C-N 113.226 -1.806 . . . . 0.0 106.942 172.429 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -74.76 155.84 37.21 Favored 'General case' 0 C--N 1.348 0.539 0 CA-C-N 113.702 -1.59 . . . . 0.0 108.184 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.1 p -107.83 179.27 4.28 Favored 'General case' 0 C--N 1.346 0.423 0 C-N-CA 119.148 -1.021 . . . . 0.0 108.331 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.8 p -82.93 -13.7 55.55 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 113.216 -1.811 . . . . 0.0 110.905 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -87.78 123.61 68.85 Favored Pre-proline 0 CA--C 1.549 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.249 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.85 -11.36 14.7 Favored 'Trans proline' 0 C--N 1.368 1.56 0 N-CA-C 116.716 1.775 . . . . 0.0 116.716 174.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.8 m-80 -95.79 -47.1 6.31 Favored 'General case' 0 C--N 1.349 0.559 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -179.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.426 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.8 tppp? -86.05 72.04 10.49 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -75.98 0.02 OUTLIER 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.202 -176.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.505 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 49.2 p-90 -103.37 155.32 18.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 113.683 -1.598 . . . . 0.0 108.313 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -162.08 150.56 15.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 118.121 -1.432 . . . . 0.0 109.188 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.8 mt -72.0 136.41 46.72 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 111.588 -2.551 . . . . 0.0 110.435 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.634 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 82.3 m -101.84 135.7 42.93 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.508 175.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -87.64 100.44 12.81 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 114.971 -2.691 . . . . 0.0 107.677 175.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -88.31 133.2 37.19 Favored Pre-proline 0 C--N 1.344 0.362 0 N-CA-C 104.129 -2.545 . . . . 0.0 104.129 176.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -64.82 117.09 4.21 Favored 'Trans proline' 0 N--CA 1.449 -1.136 0 O-C-N 124.297 1.683 . . . . 0.0 110.776 -168.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.59 140.25 58.51 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 112.725 -2.034 . . . . 0.0 107.65 176.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 80.3 m -70.89 90.04 0.79 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 119.53 -0.868 . . . . 0.0 111.083 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 27.2 p . . . . . 0 CA--C 1.542 0.669 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.312 177.548 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.654 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.447 -0.593 0 N-CA-C 102.432 -3.173 . . . . 0.0 102.432 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 8.5 t 175.15 172.39 0.26 Allowed 'General case' 0 C--O 1.225 -0.19 0 O-C-N 126.949 2.656 . . . . 0.0 104.007 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 47.14 46.26 16.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 122.89 1.329 . . . . 0.0 110.506 178.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -106.8 -29.57 9.44 Favored 'General case' 0 C--N 1.352 0.683 0 CA-C-N 110.923 -2.853 . . . . 0.0 115.077 -170.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 13.6 p -122.53 148.13 45.55 Favored 'General case' 0 C--N 1.353 0.726 0 C-N-CA 120.079 -0.648 . . . . 0.0 109.328 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.404 ' CE ' HG21 ' A' ' 77' ' ' ILE . 2.0 mpp? -135.62 172.74 12.57 Favored 'General case' 0 C--N 1.35 0.603 0 CA-C-N 113.537 -1.665 . . . . 0.0 107.933 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -81.18 -47.77 12.99 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 112.181 -2.282 . . . . 0.0 107.713 170.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 169.96 67.11 0.04 OUTLIER Glycine 0 C--N 1.351 1.376 0 CA-C-N 113.377 -1.738 . . . . 0.0 110.981 178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.1 p -152.66 -92.45 0.05 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 113.928 -1.136 . . . . 0.0 109.101 177.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 106.14 17.28 13.0 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 113.317 -1.765 . . . . 0.0 113.881 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.437 ' CD ' HH12 ' A' ' 56' ' ' ARG . 17.6 tp10 -58.96 -40.04 83.53 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 115.633 -2.427 . . . . 0.0 112.515 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 2.1 t30 -107.48 34.92 3.27 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 118.683 -1.207 . . . . 0.0 109.579 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -91.28 131.95 36.46 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.903 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -157.48 32.06 0.28 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.392 1.683 . . . . 0.0 110.968 171.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.33 44.1 2.39 Favored Glycine 0 CA--C 1.542 1.728 0 CA-C-N 114.171 -1.377 . . . . 0.0 115.438 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.64 -22.58 0.08 Allowed 'General case' 0 CA--C 1.558 1.287 0 N-CA-C 118.413 2.746 . . . . 0.0 118.413 171.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.15 135.09 29.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 CA-C-N 120.29 1.404 . . . . 0.0 109.432 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.522 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.3 t -142.47 31.8 1.49 Allowed 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.243 -1.344 . . . . 0.0 112.881 -177.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -107.65 128.2 54.33 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.37 -176.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 5.4 p -74.46 125.48 28.66 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.246 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.7 ptm -47.21 -41.59 18.51 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 111.855 -2.43 . . . . 0.0 113.87 -172.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.1 p -113.83 22.31 14.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.444 -1.253 . . . . 0.0 111.74 -175.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.83 -114.13 0.31 Allowed Glycine 0 C--N 1.352 1.426 0 C-N-CA 115.447 -3.263 . . . . 0.0 115.591 -177.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -106.51 -168.96 1.49 Allowed 'General case' 0 C--N 1.347 0.467 0 CA-C-O 122.222 1.01 . . . . 0.0 112.741 -164.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -86.27 145.24 27.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 104.946 -2.242 . . . . 0.0 104.946 170.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 20.1 m -77.39 158.27 30.16 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 124.313 2.006 . . . . 0.0 112.518 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.5 137.2 34.9 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 109.098 -3.683 . . . . 0.0 106.867 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.9 154.34 26.5 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.13 -1.396 . . . . 0.0 113.104 -176.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -76.96 -9.64 58.83 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.083 -1.417 . . . . 0.0 114.15 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -78.05 -119.63 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.401 -178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.8 t -145.28 112.92 6.29 Favored 'General case' 0 C--N 1.347 0.462 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 178.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -138.99 -74.16 0.38 Allowed 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 112.02 -2.354 . . . . 0.0 110.836 -173.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -173.69 171.64 1.59 Allowed Pre-proline 0 CA--C 1.544 0.739 0 N-CA-C 103.347 -2.834 . . . . 0.0 103.347 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -66.64 -16.93 8.19 Favored 'Cis proline' 0 C--N 1.366 1.475 0 O-C-N 123.133 1.07 . . . . 0.0 114.867 -8.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.97 168.05 14.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.212 -1.358 . . . . 0.0 107.591 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.35 80.74 2.43 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 125.019 1.449 . . . . 0.0 110.876 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -68.48 173.38 5.03 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 112.652 -2.067 . . . . 0.0 110.548 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.01 178.95 51.98 Favored Glycine 0 CA--C 1.536 1.363 0 CA-C-N 113.329 -1.76 . . . . 0.0 110.693 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 63.51 63.81 0.85 Allowed 'General case' 0 C--N 1.351 0.664 0 CA-C-N 113.513 -1.344 . . . . 0.0 110.001 -179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 94.8 mt -98.28 120.64 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-N 112.118 -2.31 . . . . 0.0 107.696 -176.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -48.92 -28.54 13.49 Favored 'Trans proline' 0 C--N 1.369 1.644 0 N-CA-C 116.858 1.83 . . . . 0.0 116.858 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.01 -13.78 18.66 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 114.448 -1.251 . . . . 0.0 114.304 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -105.81 3.69 29.0 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.684 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -125.44 112.68 25.69 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 123.988 0.805 . . . . 0.0 110.807 -176.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -74.12 -7.8 20.27 Favored 'Trans proline' 0 C--N 1.365 1.44 0 O-C-N 122.483 0.728 . . . . 0.0 112.269 162.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -76.36 161.94 28.3 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.433 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.5 OUTLIER -93.48 37.4 1.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.238 0.542 . . . . 0.0 109.995 -179.58 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -73.59 -75.89 0.14 Allowed 'General case' 0 C--N 1.351 0.653 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.57 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.68 157.64 36.87 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 117.588 -1.645 . . . . 0.0 110.491 -177.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.89 -143.13 0.14 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.476 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -69.93 -95.21 0.01 OUTLIER 'General case' 0 C--N 1.355 0.805 0 O-C-N 124.503 1.127 . . . . 0.0 108.155 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -120.24 -9.17 9.58 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.606 0.717 . . . . 0.0 110.486 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -46.52 134.03 9.61 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 114.042 -1.436 . . . . 0.0 110.465 -178.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.536 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 13.5 m -59.93 147.81 37.38 Favored 'General case' 0 C--N 1.345 0.398 0 O-C-N 124.95 1.406 . . . . 0.0 111.914 -176.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -142.0 -173.86 3.93 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.959 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 8.0 m120 -136.28 52.82 6.79 Favored Pre-proline 0 CA--C 1.55 0.98 0 CA-C-N 112.748 -2.024 . . . . 0.0 111.626 -175.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -51.81 -44.05 47.41 Favored 'Trans proline' 0 C--N 1.371 1.716 0 N-CA-C 115.959 1.484 . . . . 0.0 115.959 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.634 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.4 p-10 -96.4 -2.47 45.49 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 113.26 -1.791 . . . . 0.0 110.483 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.411 0.0 OUTLIER 50.66 66.88 1.03 Allowed 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 112.191 -2.277 . . . . 0.0 113.782 -178.791 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.594 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.2 tp10 -66.31 166.12 12.76 Favored 'General case' 0 N--CA 1.448 -0.565 1 CA-C-N 108.029 -4.169 . . . . 0.0 106.782 172.013 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.5 tp -61.67 -60.54 3.52 Favored 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.647 1.217 . . . . 0.0 110.686 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -93.65 140.17 23.01 Favored Pre-proline 0 CA--C 1.55 0.948 0 CA-C-N 113.253 -1.794 . . . . 0.0 106.541 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.52 135.98 48.27 Favored 'Trans proline' 0 C--N 1.364 1.359 0 N-CA-C 108.214 -1.495 . . . . 0.0 108.214 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.437 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 60.8 p-90 -128.54 172.47 11.14 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-O 121.971 0.891 . . . . 0.0 111.018 -175.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.8 167.05 31.13 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 113.232 -1.804 . . . . 0.0 106.491 173.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -73.85 150.79 40.74 Favored 'General case' 0 C--N 1.347 0.498 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.72 172.33 8.23 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.746 -1.182 . . . . 0.0 109.195 -176.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 p -87.8 -6.31 58.2 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.579 -1.646 . . . . 0.0 110.956 177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -78.96 136.69 57.8 Favored Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -71.76 -1.28 9.65 Favored 'Trans proline' 0 C--N 1.363 1.332 0 N-CA-C 115.619 1.353 . . . . 0.0 115.619 -175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -121.11 -33.03 3.8 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.538 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 tptm -87.14 100.56 12.75 Favored 'General case' 0 C--N 1.348 0.504 0 C-N-CA 118.214 -1.395 . . . . 0.0 108.359 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.597 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 35.4 ttt180 -58.99 -88.69 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 CA-C-N 112.906 -1.952 . . . . 0.0 111.075 179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.2 p-90 -96.23 162.65 13.43 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.926 0.87 . . . . 0.0 111.182 -178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -166.21 143.76 5.36 Favored 'General case' 0 C--N 1.347 0.461 0 CA-C-N 113.797 -1.547 . . . . 0.0 109.574 173.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 60.6 mt -69.18 139.76 54.6 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-N 113.279 -1.782 . . . . 0.0 108.915 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.641 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 83.8 m -90.73 160.07 16.01 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.059 -1.428 . . . . 0.0 111.152 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -102.51 103.48 13.84 Favored 'General case' 0 C--N 1.345 0.403 0 N-CA-C 106.662 -1.606 . . . . 0.0 106.662 174.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG21 ' CE ' ' A' ' 2' ' ' MET . 1.2 mp -113.73 143.5 29.63 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-N 112.787 -2.006 . . . . 0.0 105.715 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -69.79 122.61 9.28 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.259 1.306 . . . . 0.0 112.041 -176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 ttm180 -70.88 146.64 49.48 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m -70.65 90.02 0.75 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 118.749 -1.18 . . . . 0.0 109.46 177.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.543 0.711 0 CA-C-N 114.409 -1.269 . . . . 0.0 108.797 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.634 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . 0.532 ' H2 ' ' CG ' ' A' ' 10' ' ' ASP . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.075 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 2.6 t -70.99 112.93 7.54 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 175.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -168.04 -40.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 O-C-N 125.322 1.639 . . . . 0.0 107.017 -175.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . 0.442 ' CD ' ' HZ3' ' A' ' 12' ' ' LYS . 0.2 OUTLIER 23.9 66.67 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 110.002 -3.272 . . . . 0.0 117.883 169.224 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.452 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 1.2 p -141.28 134.04 28.77 Favored 'General case' 0 C--N 1.345 0.371 0 N-CA-C 103.406 -2.813 . . . . 0.0 103.406 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -126.42 156.85 39.96 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 123.245 1.498 . . . . 0.0 108.885 -177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -73.65 -35.35 65.26 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 111.365 -2.652 . . . . 0.0 110.048 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.63 -30.9 0.12 Allowed Glycine 0 C--N 1.349 1.304 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.937 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.0 p -99.34 -77.65 0.52 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.66 1.219 . . . . 0.0 110.263 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 80.22 77.7 0.95 Allowed Glycine 0 C--N 1.344 0.993 0 CA-C-N 113.508 -1.678 . . . . 0.0 111.578 -179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' OE1' ' NZ ' ' A' ' 44' ' ' LYS . 1.6 tm-20 -62.92 -60.84 2.91 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.672 -1.611 . . . . 0.0 107.472 175.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -94.79 43.58 1.1 Allowed 'General case' 0 C--N 1.348 0.504 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.098 -177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.49 124.12 23.93 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 115.895 -2.322 . . . . 0.0 107.439 171.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.532 ' CG ' ' H2 ' ' A' ' -4' ' ' THR . 2.8 p30 -137.04 157.4 46.81 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 102.241 -3.244 . . . . 0.0 102.241 167.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.499 ' O ' ' HG3' ' A' ' 12' ' ' LYS . . . 179.27 -86.57 0.07 OUTLIER Glycine 0 C--N 1.343 0.922 0 C-N-CA 115.537 -3.22 . . . . 0.0 111.796 -176.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 4.3 mtmm -177.81 -25.77 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 O-C-N 126.551 1.971 . . . . 0.0 110.301 -176.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -73.06 128.35 35.73 Favored 'Isoleucine or valine' 0 C--N 1.355 0.813 0 C-N-CA 118.125 -1.43 . . . . 0.0 108.922 -178.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.41 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 9.0 t -144.56 40.87 1.32 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 111.971 -2.377 . . . . 0.0 109.893 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.442 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.8 mptt -117.98 128.52 54.87 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.7 p -77.41 131.4 37.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 113.088 -1.869 . . . . 0.0 109.209 -179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.1 ptm -48.18 -33.15 8.0 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 112.42 -2.173 . . . . 0.0 114.342 -171.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.4 p -127.79 32.87 4.89 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.37 -176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.84 -93.27 0.09 OUTLIER Glycine 0 C--N 1.356 1.684 1 C-N-CA 113.663 -4.113 . . . . 0.0 117.171 -178.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -139.56 -177.62 5.03 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-O 122.937 1.351 . . . . 0.0 112.843 -164.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.3 tp10 -69.95 138.16 52.11 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 111.734 -2.485 . . . . 0.0 105.446 170.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.8 m -77.99 153.94 31.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 124.087 1.899 . . . . 0.0 110.866 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.31 135.67 33.53 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 109.709 -3.405 . . . . 0.0 106.455 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.44 151.24 24.44 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.149 -1.387 . . . . 0.0 112.424 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -70.84 -6.18 36.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 113.906 -1.497 . . . . 0.0 113.76 -177.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -73.24 -130.03 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.762 0.791 . . . . 0.0 109.849 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -144.6 121.08 11.02 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 175.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.0 -66.72 0.25 Allowed 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 112.786 -2.006 . . . . 0.0 110.608 -173.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m -173.99 168.83 2.09 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 103.421 -2.807 . . . . 0.0 103.421 -176.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -65.3 -15.65 6.76 Favored 'Cis proline' 0 C--N 1.366 1.491 0 O-C-N 123.452 1.238 . . . . 0.0 114.929 -8.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.0 167.01 15.0 Favored 'General case' 0 C--N 1.348 0.509 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.34 78.46 2.42 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 125.152 1.532 . . . . 0.0 110.521 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -66.5 170.79 5.68 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.816 -1.993 . . . . 0.0 110.192 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.46 -176.07 44.23 Favored Glycine 0 CA--C 1.536 1.383 0 C-N-CA 119.289 -1.434 . . . . 0.0 109.911 177.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 63.73 51.38 2.44 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.739 -0.731 . . . . 0.0 111.022 179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 61.7 mt -98.88 123.88 47.76 Favored Pre-proline 0 CA--C 1.543 0.674 0 CA-C-N 114.324 -1.307 . . . . 0.0 107.693 -178.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -48.8 -27.6 11.51 Favored 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.368 2.046 . . . . 0.0 117.036 -174.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.4 -15.06 33.05 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 65.2 mttp -105.13 2.19 29.09 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.294 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -121.95 112.02 32.18 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.183 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -74.25 -1.38 10.88 Favored 'Trans proline' 0 C--N 1.366 1.479 0 O-C-N 122.634 0.807 . . . . 0.0 112.121 157.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -71.23 174.88 5.83 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.283 177.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.495 ' H ' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -99.12 -4.67 31.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.187 -178.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 47' ' ' LYS 0.282 51.9 p-10 -50.54 -86.11 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 115.443 1.646 . . . . 0.0 115.443 -174.837 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 157.32 9.18 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-O 123.027 1.394 . . . . 0.0 112.81 -171.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 45' ' ' ASN . 0.0 OUTLIER -145.02 -147.96 0.23 Allowed 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 112.171 -2.286 . . . . 0.0 106.804 -174.618 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.0 mtpt -64.94 -95.02 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.887 0 O-C-N 124.912 1.383 . . . . 0.0 109.355 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.1 p-10 -124.53 -6.29 7.56 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.18 174.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -47.96 138.41 9.02 Favored 'General case' 0 C--N 1.348 0.515 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.443 -178.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.1 m -60.45 142.56 54.96 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 124.727 1.267 . . . . 0.0 110.121 -179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -132.82 -170.1 2.38 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -145.5 63.48 9.67 Favored Pre-proline 0 CA--C 1.548 0.873 0 CA-C-N 113.027 -1.897 . . . . 0.0 108.577 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.48 -41.49 64.59 Favored 'Trans proline' 0 C--N 1.373 1.843 0 CA-C-O 123.237 1.265 . . . . 0.0 114.387 -178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.682 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.0 OUTLIER -96.72 6.02 49.52 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 111.157 -2.747 . . . . 0.0 110.082 177.278 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.367 0.0 OUTLIER 34.96 66.39 0.31 Allowed 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 112.327 -2.215 . . . . 0.0 114.063 179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.538 ' OE1' ' H71' ' A' ' 84' ' ' AMH . 20.4 tt0 -73.74 -177.52 2.8 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 108.601 -3.909 . . . . 0.0 105.041 172.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 64.9 tp -72.44 -91.58 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 118.114 -1.434 . . . . 0.0 108.015 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.8 ttm-85 -61.22 126.09 85.42 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.376 -178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.18 133.64 38.94 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.119 1.879 . . . . 0.0 109.437 -172.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.441 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 58.3 p-90 -119.25 166.03 13.5 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 122.301 1.048 . . . . 0.0 111.725 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.5 p -154.43 167.65 29.31 Favored 'General case' 0 C--N 1.344 0.362 0 CA-C-N 112.974 -1.921 . . . . 0.0 106.507 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -76.29 149.62 37.07 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.565 177.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.41 170.33 9.44 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 119.096 -1.042 . . . . 0.0 109.115 -176.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 p -86.85 -6.47 58.79 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 113.939 -1.482 . . . . 0.0 110.897 177.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -77.54 135.45 64.83 Favored Pre-proline 0 CA--C 1.548 0.885 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -71.76 -0.43 8.35 Favored 'Trans proline' 0 C--N 1.363 1.323 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 -175.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.24 -31.42 4.39 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.537 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -90.02 103.3 15.98 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 118.586 -1.245 . . . . 0.0 108.633 179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.602 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.3 ttt180 -61.88 -93.15 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.018 -1.901 . . . . 0.0 110.755 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 44.0 p-90 -92.91 163.47 13.68 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.805 0.812 . . . . 0.0 110.818 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -166.36 144.84 5.56 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 114.037 -1.438 . . . . 0.0 110.054 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.4 130.84 41.0 Favored 'General case' 0 C--N 1.351 0.65 0 CA-C-N 112.843 -1.98 . . . . 0.0 108.589 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.568 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 74.3 m -83.12 174.97 10.34 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 115.106 -0.952 . . . . 0.0 111.074 177.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -120.95 111.25 17.27 Favored 'General case' 0 C--N 1.346 0.43 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 171.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -115.24 147.09 37.78 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 112.758 -2.019 . . . . 0.0 107.55 -173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -57.72 126.34 21.51 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.831 1.687 . . . . 0.0 115.148 176.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -74.84 147.11 41.4 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 113.788 -1.551 . . . . 0.0 107.386 174.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.452 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 87.0 m -74.91 77.95 2.15 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 119.222 -0.991 . . . . 0.0 110.663 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 CA--C 1.539 0.554 0 CA-C-N 114.309 -1.314 . . . . 0.0 108.266 178.148 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.682 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 105.938 -1.875 . . . . 0.0 105.938 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 29.7 t -73.96 160.39 31.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 112.088 -2.324 . . . . 0.0 106.339 171.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.36 27.34 3.44 Favored 'General case' 0 CA--C 1.541 0.626 0 O-C-N 126.018 2.073 . . . . 0.0 108.57 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.37 70.37 2.26 Favored 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 115.813 1.782 . . . . 0.0 115.813 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.439 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -164.47 129.04 2.65 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 104.811 -2.292 . . . . 0.0 104.811 168.854 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.443 ' SD ' ' HB2' ' A' ' 9' ' ' TYR . 0.7 OUTLIER -123.44 151.94 42.15 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-O 122.936 1.35 . . . . 0.0 108.971 -177.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.24 -38.37 60.61 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 111.673 -2.512 . . . . 0.0 108.69 173.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.51 -74.34 0.03 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 118.782 -1.675 . . . . 0.0 113.656 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.9 p -90.79 -27.21 19.03 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -170.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 56.52 49.08 71.8 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 118.947 -1.596 . . . . 0.0 115.207 176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -63.77 -26.03 68.45 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 117.207 -1.797 . . . . 0.0 111.514 178.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 55.8 t30 -98.16 -9.41 25.78 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 118.528 -1.269 . . . . 0.0 112.15 178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.443 ' HB2' ' SD ' ' A' ' 2' ' ' MET . 8.8 t80 -69.04 122.12 18.07 Favored 'General case' 0 C--N 1.349 0.571 0 O-C-N 124.78 1.3 . . . . 0.0 112.721 -176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -144.47 66.42 1.27 Allowed 'General case' 0 CA--C 1.547 0.835 0 O-C-N 124.864 1.353 . . . . 0.0 107.462 172.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.31 -110.74 1.65 Allowed Glycine 0 C--N 1.351 1.392 0 CA-C-N 114.221 -1.354 . . . . 0.0 110.12 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.48 -13.81 1.3 Allowed 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -176.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.1 mp -74.9 133.23 31.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 118.245 -1.382 . . . . 0.0 109.583 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.499 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.8 t -140.22 20.38 2.42 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 112.961 -1.927 . . . . 0.0 113.236 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.39 123.82 42.72 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.003 -1.079 . . . . 0.0 109.488 -175.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.419 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 12.2 p -69.7 132.83 46.74 Favored 'General case' 0 C--N 1.35 0.628 0 CA-C-O 122.318 1.056 . . . . 0.0 109.865 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 10.0 ptp -44.2 -49.28 9.21 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 113.394 -1.73 . . . . 0.0 112.737 -173.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -113.1 32.23 5.87 Favored 'General case' 0 N--CA 1.451 -0.422 0 O-C-N 124.69 1.244 . . . . 0.0 112.701 -176.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.98 -97.12 0.12 Allowed Glycine 0 C--N 1.356 1.689 1 C-N-CA 113.614 -4.136 . . . . 0.0 117.325 -178.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 mp -132.57 174.51 10.2 Favored 'General case' 0 C--N 1.35 0.589 0 CA-C-O 121.878 0.846 . . . . 0.0 112.227 -164.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -73.95 135.55 43.23 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 171.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 5.2 m -74.06 159.21 32.97 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 124.368 2.032 . . . . 0.0 112.739 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.479 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -93.17 137.88 32.1 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 108.972 -3.74 . . . . 0.0 106.075 178.385 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.36 155.53 21.18 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 114.46 -1.246 . . . . 0.0 113.211 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -72.02 -1.99 16.67 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 114.722 -1.126 . . . . 0.0 113.055 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -81.3 -141.63 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.51 122.3 24.65 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 106.099 -1.815 . . . . 0.0 106.099 179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.56 -78.99 0.14 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 113.051 -1.886 . . . . 0.0 111.959 -170.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.4 p 172.28 145.84 0.16 Allowed Pre-proline 0 N--CA 1.449 -0.492 0 N-CA-C 103.493 -2.78 . . . . 0.0 103.493 -176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -75.02 -17.18 20.37 Favored 'Cis proline' 0 C--N 1.363 1.332 0 N-CA-C 118.385 2.417 . . . . 0.0 118.385 11.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -171.21 156.68 4.79 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 118.079 -1.448 . . . . 0.0 110.652 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.36 80.99 1.38 Allowed 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.265 -1.789 . . . . 0.0 110.829 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.479 ' CD2' HE22 ' A' ' 23' ' ' GLN . 16.7 p80 -69.95 176.71 3.55 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 112.497 -2.138 . . . . 0.0 111.167 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.73 179.86 52.09 Favored Glycine 0 C--N 1.352 1.433 0 CA-C-N 113.396 -1.729 . . . . 0.0 110.571 177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 66.47 65.22 0.48 Allowed 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.792 1.282 . . . . 0.0 109.28 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 56.5 mt -91.81 116.04 65.71 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 111.523 -2.581 . . . . 0.0 108.504 -174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -49.77 -30.58 23.32 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 121.689 1.593 . . . . 0.0 116.009 -178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.35 -12.85 15.61 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 113.982 -1.463 . . . . 0.0 114.224 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -107.22 4.82 27.09 Favored 'General case' 0 C--N 1.346 0.442 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.588 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -124.13 114.2 27.86 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 124.047 0.842 . . . . 0.0 110.664 -177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -74.47 -5.81 17.43 Favored 'Trans proline' 0 C--N 1.367 1.519 0 O-C-N 122.506 0.74 . . . . 0.0 112.375 161.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -72.99 163.95 27.41 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -91.32 8.4 36.24 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.085 -0.646 . . . . 0.0 110.655 179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.271 45.5 p-10 -48.7 -76.13 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.758 0 O-C-N 124.815 1.322 . . . . 0.0 114.365 -174.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.39 153.58 40.39 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 117.019 -1.872 . . . . 0.0 110.589 -176.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -137.79 -142.78 0.17 Allowed 'General case' 0 C--N 1.349 0.573 0 CA-C-N 112.912 -1.949 . . . . 0.0 107.314 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -72.92 -97.11 0.01 OUTLIER 'General case' 0 C--N 1.356 0.852 0 C-N-CA 119.113 -1.035 . . . . 0.0 108.351 173.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.7 p-10 -115.04 -10.55 12.22 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.712 -0.795 . . . . 0.0 111.599 178.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -47.28 132.9 12.64 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.462 -179.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 16.8 m -61.71 145.74 51.42 Favored 'General case' 0 C--N 1.344 0.353 0 CA-C-N 113.692 -1.594 . . . . 0.0 111.753 -175.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -138.21 -172.49 3.28 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 112.775 -2.011 . . . . 0.0 106.651 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -146.83 61.07 6.35 Favored Pre-proline 0 C--O 1.218 -0.591 0 C-N-CA 116.701 -1.999 . . . . 0.0 111.102 178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.17 -29.34 55.79 Favored 'Trans proline' 0 C--N 1.364 1.385 0 N-CA-C 117.242 1.978 . . . . 0.0 117.242 -172.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.702 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.4 p30 -113.42 18.89 17.4 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.813 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 24.77 68.19 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 129.158 2.983 . . . . 0.0 115.892 -176.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.618 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 9.1 tp10 -63.28 170.67 2.81 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 109.629 -3.441 . . . . 0.0 108.028 172.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.7 tp -53.01 -56.35 16.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 122.043 0.925 . . . . 0.0 111.742 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.2 tpm_? -105.53 148.83 37.03 Favored Pre-proline 0 CA--C 1.543 0.71 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.46 ' HG2' HG13 ' A' ' 77' ' ' ILE . 54.2 Cg_endo -66.14 142.17 66.43 Favored 'Trans proline' 0 C--N 1.366 1.457 0 N-CA-C 108.112 -1.534 . . . . 0.0 108.112 170.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.403 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 67.0 p-90 -126.75 177.69 6.4 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 124.898 1.374 . . . . 0.0 109.283 -176.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.9 p -160.69 167.06 27.71 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 112.394 -2.185 . . . . 0.0 106.556 174.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -79.31 140.55 37.51 Favored 'General case' 0 C--N 1.349 0.572 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.71 175.77 7.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 118.736 -1.186 . . . . 0.0 109.278 -175.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -86.01 -11.48 52.83 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.914 178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -78.89 124.21 84.97 Favored Pre-proline 0 CA--C 1.551 1.016 0 O-C-N 123.925 0.766 . . . . 0.0 109.653 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.74 -2.37 0.45 Allowed 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 118.45 2.442 . . . . 0.0 118.45 170.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -114.22 -43.71 3.19 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -85.99 95.71 9.59 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 118.436 -1.306 . . . . 0.0 108.542 179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.577 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 18.5 ttt180 -57.42 -82.83 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.217 -1.811 . . . . 0.0 111.683 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 40.7 p-90 -99.93 162.3 13.07 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.91 0.862 . . . . 0.0 110.9 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -164.9 148.28 8.63 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 114.136 -1.393 . . . . 0.0 109.813 173.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 62.2 mt -69.94 144.95 52.23 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.267 -2.242 . . . . 0.0 109.063 177.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.518 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 86.3 m -90.31 163.23 14.82 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 123.137 1.446 . . . . 0.0 114.168 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -102.82 76.4 1.49 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 111.224 -2.716 . . . . 0.0 107.443 -178.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.46 HG13 ' HG2' ' A' ' 61' ' ' PRO . 39.9 mm -101.43 135.31 19.87 Favored Pre-proline 0 CA--C 1.542 0.656 0 CA-C-N 113.124 -1.853 . . . . 0.0 110.349 -174.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -63.59 125.95 16.57 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 121.576 1.517 . . . . 0.0 112.118 178.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.8 tpp180 -71.7 142.62 49.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 112.951 -1.931 . . . . 0.0 108.069 177.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.439 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 73.5 m -69.09 93.31 0.58 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 118.569 -1.252 . . . . 0.0 110.255 175.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 114.104 -1.407 . . . . 0.0 108.405 178.693 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.702 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.915 0.864 . . . . 0.0 108.852 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -125.43 94.72 4.23 Favored 'General case' 0 C--N 1.343 0.291 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 175.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.31 120.35 22.95 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 113.449 -1.705 . . . . 0.0 109.522 -172.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -84.72 -46.27 11.6 Favored 'General case' 0 C--N 1.351 0.644 0 CA-C-N 113.182 -1.826 . . . . 0.0 112.279 -177.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.428 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 19.9 p -99.43 152.46 19.95 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 -178.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 28.7 mmt -119.3 155.11 32.42 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-O 123.305 1.526 . . . . 0.0 111.204 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.0 m80 -65.74 -29.7 70.25 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 110.709 -2.95 . . . . 0.0 110.176 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 139.94 31.33 0.18 Allowed Glycine 0 C--N 1.352 1.429 0 CA-C-N 113.994 -1.457 . . . . 0.0 113.275 176.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 34.0 p -135.82 -62.39 0.69 Allowed 'General case' 0 C--N 1.351 0.647 0 CA-C-O 122.833 1.301 . . . . 0.0 110.447 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 94.98 13.34 53.33 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 112.401 -2.182 . . . . 0.0 111.96 -177.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 50.1 tp10 -52.86 -39.52 62.65 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 113.375 -1.412 . . . . 0.0 110.515 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -118.88 55.92 0.91 Allowed 'General case' 0 C--N 1.352 0.696 0 CA-C-N 113.061 -1.882 . . . . 0.0 108.067 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -85.02 116.51 23.45 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 171.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -148.05 42.53 1.03 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.684 177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -89.8 -131.24 4.39 Favored Glycine 0 C--N 1.354 1.529 0 CA-C-N 113.491 -1.686 . . . . 0.0 110.287 178.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -138.22 0.76 2.15 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -74.29 138.24 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.0 t -139.44 36.21 2.05 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 113.373 -1.74 . . . . 0.0 110.981 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' A' ' 21' ' ' GLU . 11.3 mptt -122.62 123.13 40.46 Favored 'General case' 0 C--N 1.349 0.562 0 C-N-CA 119.232 -0.987 . . . . 0.0 109.292 -178.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.514 HG21 HG22 ' A' ' 65' ' ' THR . 28.1 p -81.85 126.14 31.53 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.51 -1.677 . . . . 0.0 110.347 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 18.3 ptm -39.28 -42.9 1.07 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 128.459 2.704 . . . . 0.0 115.33 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.8 p -112.2 -41.32 3.96 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 114.08 -1.418 . . . . 0.0 111.235 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 -116.79 0.05 OUTLIER Glycine 0 CA--C 1.547 2.056 0 CA-C-N 113.08 -1.873 . . . . 0.0 114.566 -176.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.8 mp -141.83 -155.71 0.61 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.791 0.805 . . . . 0.0 109.052 -171.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 4.9 tp10 -69.67 145.44 52.38 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.442 ' SG ' HG23 ' A' ' 16' ' ' THR . 8.6 m -78.25 140.25 38.89 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 123.798 1.761 . . . . 0.0 110.835 177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.402 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.7 OUTLIER -94.22 133.14 38.06 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 110.02 -3.264 . . . . 0.0 104.377 175.736 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.13 152.58 40.18 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-N 113.197 -1.819 . . . . 0.0 114.768 -171.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -71.84 -6.72 43.7 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.318 -1.31 . . . . 0.0 112.036 178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -72.11 -160.69 0.07 Allowed 'General case' 0 CA--C 1.55 0.97 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 179.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -114.05 106.81 14.84 Favored 'General case' 0 C--N 1.344 0.345 0 N-CA-C 105.447 -2.057 . . . . 0.0 105.447 177.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.88 -70.73 0.32 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 113.01 -1.905 . . . . 0.0 110.752 -174.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 p -173.25 169.01 2.34 Favored Pre-proline 0 CA--C 1.538 0.497 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -66.76 -9.72 6.86 Favored 'Cis proline' 0 C--N 1.365 1.429 0 N-CA-C 115.445 1.287 . . . . 0.0 115.445 -10.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -161.09 154.49 21.71 Favored 'General case' 0 C--N 1.348 0.511 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.45 84.14 1.98 Allowed 'General case' 0 CA--C 1.545 0.767 0 O-C-N 124.785 1.303 . . . . 0.0 109.007 176.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.402 ' CD2' HE22 ' A' ' 23' ' ' GLN . 8.3 p80 -72.79 171.83 11.92 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 112.308 -2.224 . . . . 0.0 109.507 178.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -76.21 -172.53 34.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.396 -1.383 . . . . 0.0 110.267 176.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 60.16 67.66 0.84 Allowed 'General case' 0 CA--C 1.548 0.892 0 O-C-N 124.518 0.775 . . . . 0.0 109.26 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 28.2 mt -114.1 129.78 24.5 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.205 -1.362 . . . . 0.0 109.275 -174.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -49.77 -22.04 6.52 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.117 1.878 . . . . 0.0 116.925 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.5 m -58.41 -22.08 52.85 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -107.02 1.05 24.07 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.783 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -129.12 104.68 18.13 Favored Pre-proline 0 CA--C 1.54 0.594 0 O-C-N 123.941 0.776 . . . . 0.0 110.711 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -71.92 -3.24 12.83 Favored 'Trans proline' 0 C--N 1.365 1.426 0 CA-C-O 121.92 0.717 . . . . 0.0 112.569 164.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -69.94 168.0 16.24 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 113.885 -1.507 . . . . 0.0 109.607 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.27 8.85 25.32 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.333 -1.303 . . . . 0.0 111.228 -179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.284 46.4 p-10 -66.2 -107.34 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 O-C-N 124.612 1.195 . . . . 0.0 110.699 177.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.05 125.9 22.41 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 122.691 1.234 . . . . 0.0 111.232 -175.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.28 -137.7 0.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 112.479 -2.146 . . . . 0.0 106.556 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.34 -108.83 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.022 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.7 p-10 -110.09 14.46 22.92 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 121.82 0.819 . . . . 0.0 112.281 -177.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -76.31 135.44 39.58 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.726 177.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.452 ' O ' ' CD ' ' A' ' 52' ' ' ARG . 3.8 m -54.61 165.82 0.54 Allowed 'General case' 0 CA--C 1.539 0.546 0 O-C-N 125.015 1.447 . . . . 0.0 111.282 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' CD ' ' O ' ' A' ' 51' ' ' CYS . 4.1 mpt_? -157.24 -178.72 7.57 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 126.875 2.07 . . . . 0.0 107.283 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -128.44 62.48 59.67 Favored Pre-proline 0 C--N 1.355 0.842 0 O-C-N 125.756 1.91 . . . . 0.0 109.227 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -58.31 -50.6 9.37 Favored 'Trans proline' 0 C--N 1.367 1.52 0 CA-C-N 119.336 0.799 . . . . 0.0 113.907 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.64 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.3 p-10 -96.22 4.56 52.31 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 112.879 -1.964 . . . . 0.0 110.548 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER 37.32 75.23 0.07 Allowed 'General case' 0 C--N 1.352 0.69 0 C-N-CA 126.486 1.914 . . . . 0.0 114.507 179.604 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.92 -150.56 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.888 -3.778 . . . . 0.0 109.32 174.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.5 tt -77.41 -70.79 0.45 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.53 -1.668 . . . . 0.0 110.869 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 41.5 ttt180 -114.2 135.16 22.14 Favored Pre-proline 0 CA--C 1.554 1.126 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.665 -178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.43 137.95 72.98 Favored 'Trans proline' 0 C--N 1.37 1.683 0 C-N-CA 123.087 2.525 . . . . 0.0 112.716 -170.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.436 ' HB3' HD23 ' A' ' 74' ' ' LEU . 66.3 p-90 -118.38 175.74 5.57 Favored 'General case' 0 C--N 1.349 0.568 0 CA-C-O 122.558 1.17 . . . . 0.0 111.428 -179.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 0.8 OUTLIER -159.89 168.02 26.72 Favored 'General case' 0 C--N 1.344 0.366 0 CA-C-N 111.408 -2.633 . . . . 0.0 105.453 173.068 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -73.72 157.07 37.18 Favored 'General case' 0 C--N 1.348 0.52 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.514 HG22 HG21 ' A' ' 16' ' ' THR . 1.8 p -104.91 169.57 8.37 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.9 p -74.79 -7.72 54.24 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-N 114.042 -1.435 . . . . 0.0 112.041 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -91.06 131.39 37.19 Favored Pre-proline 0 CA--C 1.55 0.952 0 O-C-N 123.603 0.564 . . . . 0.0 109.65 -179.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.36 2.92 5.72 Favored 'Trans proline' 0 C--N 1.367 1.511 0 C-N-CA 121.704 1.603 . . . . 0.0 115.839 -176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -112.74 -41.43 3.8 Favored 'General case' 0 C--N 1.345 0.384 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.56 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -89.21 70.63 8.3 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 176.032 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.524 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 3.3 tmm_? -49.57 -71.66 0.06 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 112.796 -2.002 . . . . 0.0 111.513 -176.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.402 ' CD2' ' H51' ' A' ' 84' ' ' AMH . 63.1 p-90 -96.32 151.32 19.63 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 123.939 0.774 . . . . 0.0 109.955 176.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.56 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 5.6 tp10 -160.68 144.78 13.82 Favored 'General case' 0 C--N 1.353 0.729 0 C-N-CA 118.248 -1.381 . . . . 0.0 110.793 171.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 62' ' ' TRP . 20.5 mt -68.51 141.6 55.51 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 112.734 -2.03 . . . . 0.0 110.566 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.499 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 91.2 m -86.06 150.27 24.57 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.04 178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -97.46 94.07 6.82 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 174.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.8 mm -98.2 139.7 21.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.171 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.99 129.54 29.22 Favored 'Trans proline' 0 C--N 1.363 1.338 0 C-N-CA 121.684 1.589 . . . . 0.0 111.911 173.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -72.84 142.59 48.0 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.052 -1.431 . . . . 0.0 107.718 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.428 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 82.9 m -76.41 74.53 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 118.936 -1.106 . . . . 0.0 109.514 176.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 CA--C 1.538 0.499 0 CA-C-N 114.048 -1.433 . . . . 0.0 107.807 -178.329 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.64 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.945 0 N-CA-C 103.227 -2.879 . . . . 0.0 103.227 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 11.9 t -76.09 -174.69 2.82 Favored 'General case' 0 C--N 1.346 0.416 0 O-C-N 125.971 2.045 . . . . 0.0 107.461 176.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 58.92 48.94 10.36 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 112.907 -1.951 . . . . 0.0 112.844 175.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -150.07 -64.87 0.21 Allowed 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 111.609 -2.541 . . . . 0.0 108.348 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.462 ' C ' ' SG ' ' A' ' 80' ' ' CYS . 13.9 p -110.21 147.4 33.84 Favored 'General case' 0 C--N 1.347 0.496 0 CA-C-N 113.359 -1.746 . . . . 0.0 107.456 177.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -131.46 161.29 32.84 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 125.651 1.845 . . . . 0.0 106.384 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -73.17 -35.47 66.43 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 112.982 -1.917 . . . . 0.0 110.917 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.51 -68.3 0.04 OUTLIER Glycine 0 C--N 1.354 1.565 0 C-N-CA 116.791 -2.623 . . . . 0.0 114.529 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.1 p -92.15 -16.21 26.6 Favored 'General case' 0 C--N 1.351 0.669 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -170.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 57.49 42.96 94.19 Favored Glycine 0 CA--C 1.543 1.84 0 C-N-CA 117.925 -2.083 . . . . 0.0 113.936 177.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -47.76 -54.27 12.79 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 112.645 -1.778 . . . . 0.0 111.547 -179.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -107.41 18.59 21.37 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.013 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.401 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 11.5 t80 -82.36 116.95 22.08 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.335 178.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.422 ' OD2' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -133.12 41.69 3.1 Favored 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.43 -89.03 0.41 Allowed Glycine 0 C--N 1.35 1.317 0 N-CA-C 118.653 2.221 . . . . 0.0 118.653 -169.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.2 mttp -150.48 -33.99 0.17 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 117.652 -1.619 . . . . 0.0 114.417 -170.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.33 129.9 32.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 N-CA-C 107.607 -1.257 . . . . 0.0 107.607 -179.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 t -141.27 45.83 1.74 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 110.75 -2.932 . . . . 0.0 108.049 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.434 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -132.47 122.74 25.39 Favored 'General case' 0 C--N 1.347 0.486 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 -178.03 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 10.1 p -80.38 134.5 36.03 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.61 -175.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -43.39 -36.19 1.84 Allowed 'General case' 0 C--N 1.349 0.578 0 CA-C-N 111.705 -2.498 . . . . 0.0 114.209 -172.541 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.0 p -129.97 32.22 4.57 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.591 -177.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.02 -90.73 0.08 OUTLIER Glycine 0 C--N 1.357 1.695 1 C-N-CA 112.754 -4.546 . . . . 0.0 118.492 -176.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 16.9 mt -133.76 177.64 7.55 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-O 123.008 1.385 . . . . 0.0 113.207 -161.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.434 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.8 tp10 -77.17 143.19 39.25 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.565 -2.562 . . . . 0.0 106.409 172.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 31.4 m -79.46 145.55 33.22 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 123.738 1.733 . . . . 0.0 111.765 178.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.523 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -90.18 135.28 33.76 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 110.332 -3.122 . . . . 0.0 105.231 176.526 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.71 154.69 17.42 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 114.633 -1.167 . . . . 0.0 113.115 -175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -74.0 7.66 2.52 Favored 'General case' 0 CA--C 1.548 0.894 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 -175.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -80.73 -134.24 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.798 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.6 t -145.84 105.24 3.94 Favored 'General case' 0 C--N 1.346 0.438 0 N-CA-C 105.889 -1.893 . . . . 0.0 105.889 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.52 -81.45 0.32 Allowed 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 112.603 -2.089 . . . . 0.0 112.378 -170.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 p 178.31 143.95 0.3 Allowed Pre-proline 0 N--CA 1.447 -0.611 0 N-CA-C 104.074 -2.565 . . . . 0.0 104.074 -175.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -71.93 -10.18 15.93 Favored 'Cis proline' 0 C--N 1.362 1.276 0 N-CA-C 119.861 2.985 . . . . 0.0 119.861 8.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 147.84 7.63 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 117.308 -1.757 . . . . 0.0 111.187 -176.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.97 72.1 5.47 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 113.642 -1.617 . . . . 0.0 108.535 175.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.523 ' CD2' HE22 ' A' ' 23' ' ' GLN . 21.7 p80 -68.86 172.35 6.65 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 112.363 -2.199 . . . . 0.0 111.771 -177.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -79.5 175.86 54.89 Favored Glycine 0 CA--C 1.536 1.37 0 CA-C-N 113.341 -1.754 . . . . 0.0 109.732 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 67.48 63.59 0.42 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.79 0.805 . . . . 0.0 109.587 -178.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.9 mt -106.58 127.41 28.21 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 113.592 -1.64 . . . . 0.0 107.176 -177.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -56.22 -21.25 35.04 Favored 'Trans proline' 0 C--N 1.369 1.617 0 C-N-CA 121.534 1.489 . . . . 0.0 115.419 -173.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.2 m -62.19 -14.49 38.34 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.635 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -106.0 0.49 25.72 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.9 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -122.79 112.19 30.77 Favored Pre-proline 0 C--N 1.348 0.523 0 C-N-CA 120.051 -0.659 . . . . 0.0 111.63 -176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -75.58 -5.89 17.04 Favored 'Trans proline' 0 CA--C 1.551 1.363 0 O-C-N 122.611 0.795 . . . . 0.0 111.314 156.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -72.91 151.36 41.94 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-N 114.255 -1.339 . . . . 0.0 108.347 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.43 72.32 7.98 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.259 46.5 p-10 -115.33 -90.41 0.54 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.147 -1.388 . . . . 0.0 111.702 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.32 151.33 19.89 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.058 0.932 . . . . 0.0 111.37 -174.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -137.7 -142.08 0.16 Allowed 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.249 -1.796 . . . . 0.0 106.821 -177.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.1 mtmm -65.23 -95.48 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 O-C-N 124.432 1.082 . . . . 0.0 109.899 177.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -129.52 11.89 5.84 Favored 'General case' 0 C--O 1.221 -0.41 0 CA-C-N 115.175 -0.921 . . . . 0.0 109.811 177.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -69.43 145.05 53.12 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 114.108 -1.406 . . . . 0.0 109.459 -177.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 3.6 m -63.39 129.28 39.56 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 113.669 -1.605 . . . . 0.0 110.966 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 10.3 mmm180 -124.8 -165.32 1.37 Allowed 'General case' 0 C--N 1.345 0.394 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -152.58 65.72 6.01 Favored Pre-proline 0 CA--C 1.544 0.733 0 C-N-CA 117.997 -1.481 . . . . 0.0 111.177 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -52.33 -43.47 53.68 Favored 'Trans proline' 0 C--N 1.366 1.469 0 N-CA-C 116.001 1.5 . . . . 0.0 116.001 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.634 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.5 p-10 -96.98 0.98 49.72 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.391 -1.731 . . . . 0.0 110.856 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.506 0.0 OUTLIER 44.06 67.7 0.63 Allowed 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 112.324 -2.216 . . . . 0.0 114.983 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.524 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.3 tp10 -65.2 167.52 8.1 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 109.086 -3.688 . . . . 0.0 107.642 173.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.5 tp -54.26 -55.38 28.74 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 114.99 -1.004 . . . . 0.0 111.975 -178.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -105.33 143.06 26.02 Favored Pre-proline 0 CA--C 1.553 1.08 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.48 141.13 45.53 Favored 'Trans proline' 0 C--N 1.367 1.523 0 N-CA-C 108.758 -1.285 . . . . 0.0 108.758 178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.442 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 65.7 p-90 -126.57 173.77 9.19 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 124.56 1.163 . . . . 0.0 110.312 -175.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 1.1 p -157.62 166.06 33.86 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 112.395 -2.184 . . . . 0.0 106.402 173.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -76.45 153.2 35.82 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.833 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.82 177.39 4.86 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-O 122.144 0.974 . . . . 0.0 109.98 -178.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 15.5 p -84.88 -5.75 59.34 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.035 -1.893 . . . . 0.0 112.047 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -88.67 124.54 65.47 Favored Pre-proline 0 CA--C 1.55 0.969 0 O-C-N 123.805 0.691 . . . . 0.0 109.936 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -55.01 -2.68 0.23 Allowed 'Trans proline' 0 C--N 1.367 1.55 0 N-CA-C 119.102 2.693 . . . . 0.0 119.102 169.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -114.71 -44.5 3.06 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -86.04 88.48 7.59 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 118.496 -1.282 . . . . 0.0 108.877 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.612 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 28.3 ttt180 -54.02 -84.05 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 113.494 -1.684 . . . . 0.0 111.32 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -98.43 159.72 14.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.939 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HG2' ' SD ' ' A' ' 17' ' ' MET . 25.7 tt0 -165.19 145.42 7.05 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 114.146 -1.388 . . . . 0.0 109.622 172.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.94 149.63 47.58 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 112.684 -2.053 . . . . 0.0 109.541 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 89.4 m -106.21 132.16 52.6 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 124.206 0.941 . . . . 0.0 110.463 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.4 t0 -87.46 85.42 7.13 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 115.856 -2.337 . . . . 0.0 108.704 177.015 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.8 mm -74.47 138.94 74.49 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 111.419 -2.628 . . . . 0.0 108.594 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -48.64 126.72 14.92 Favored 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 122.247 1.965 . . . . 0.0 113.42 177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.39 136.14 39.48 Favored 'General case' 0 C--N 1.347 0.474 0 C-N-CA 119.002 -1.079 . . . . 0.0 108.877 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.462 ' SG ' ' C ' ' A' ' 1' ' ' CYS . 89.1 m -79.45 72.99 6.11 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 118.819 -1.152 . . . . 0.0 107.934 172.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 21.7 p . . . . . 0 CA--C 1.537 0.481 0 CA-C-N 113.638 -1.619 . . . . 0.0 107.959 -177.315 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.634 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 102.3 -3.222 . . . . 0.0 102.3 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 16.2 p -166.96 171.22 11.38 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 126.304 2.253 . . . . 0.0 105.539 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -121.95 101.2 7.41 Favored 'General case' 0 C--O 1.219 -0.502 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 175.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -74.56 -29.14 61.24 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.767 -175.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.1 p -120.49 148.91 43.21 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -121.9 161.6 22.51 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-O 123.343 1.545 . . . . 0.0 111.385 -174.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -71.32 -25.71 62.53 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 110.88 -2.873 . . . . 0.0 111.692 176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.47 -27.3 1.21 Allowed Glycine 0 CA--C 1.537 1.419 0 O-C-N 124.645 1.215 . . . . 0.0 113.471 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.3 p -94.59 -55.0 3.29 Favored 'General case' 0 C--N 1.349 0.581 0 CA-C-O 122.916 1.341 . . . . 0.0 112.142 -175.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 87.71 24.93 34.04 Favored Glycine 0 CA--C 1.532 1.128 0 CA-C-N 112.4 -2.182 . . . . 0.0 111.609 -177.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -36.83 66.2 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 113.896 -1.152 . . . . 0.0 112.511 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -106.92 9.81 30.67 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.667 178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -66.12 119.83 12.13 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -144.79 147.91 33.45 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 110.463 -3.062 . . . . 0.0 104.101 162.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.38 -92.63 0.08 OUTLIER Glycine 0 C--N 1.346 1.131 0 C-N-CA 119.406 -1.378 . . . . 0.0 110.143 -178.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 46.9 mttp -156.55 -23.25 0.1 Allowed 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 113.971 -1.114 . . . . 0.0 113.013 -176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.4 mp -76.82 127.73 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 119.176 -1.009 . . . . 0.0 109.146 -177.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.461 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 10.7 t -145.25 27.2 1.28 Allowed 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.454 -1.703 . . . . 0.0 111.211 177.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.2 tmtt? -103.26 123.27 46.45 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.573 1.177 . . . . 0.0 108.736 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.443 HG22 ' SG ' ' A' ' 22' ' ' CYS . 3.6 p -68.07 134.48 50.69 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 112.587 -2.097 . . . . 0.0 109.983 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 14.0 ptt? -35.6 -32.24 0.02 OUTLIER 'General case' 0 C--N 1.349 0.586 0 C-N-CA 128.694 2.798 . . . . 0.0 114.991 -174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.412 ' O ' ' NZ ' ' A' ' 15' ' ' LYS 0.254 4.0 m -139.79 -66.38 0.45 Allowed 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -20.14 -108.56 0.0 OUTLIER Glycine 0 CA--C 1.544 1.904 0 O-C-N 126.239 2.212 . . . . 0.0 116.615 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mp -139.21 -165.42 1.85 Allowed 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 48.0 tp10 -82.46 148.08 28.37 Favored 'General case' 0 C--N 1.347 0.465 0 N-CA-C 105.247 -2.131 . . . . 0.0 105.247 172.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.443 ' SG ' HG22 ' A' ' 16' ' ' THR . 52.1 m -76.88 149.97 36.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 123.938 1.827 . . . . 0.0 112.425 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.81 135.34 33.79 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 109.898 -3.319 . . . . 0.0 106.613 177.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.12 143.61 48.19 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.042 -0.981 . . . . 0.0 112.392 -177.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.22 -14.15 53.61 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 117.805 2.521 . . . . 0.0 117.805 -172.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.66 -143.95 0.09 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 116.089 -2.244 . . . . 0.0 110.2 -176.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.9 t -105.34 113.35 26.87 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.255 0.1 OUTLIER -141.47 -79.64 0.25 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-N 113.357 -1.747 . . . . 0.0 111.381 -174.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.9 p 167.92 129.84 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.936 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -61.01 -67.81 0.03 OUTLIER 'Cis proline' 0 C--N 1.368 1.582 0 N-CA-C 120.48 3.223 . . . . 0.0 120.48 20.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.42 161.28 35.46 Favored 'General case' 0 C--N 1.346 0.455 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -74.28 75.76 1.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.046 -1.434 . . . . 0.0 110.854 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -68.82 172.87 5.87 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 112.739 -2.028 . . . . 0.0 110.156 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -73.39 172.94 49.74 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 114.484 -1.235 . . . . 0.0 111.634 178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 68.0 58.69 0.46 Allowed 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.458 -1.371 . . . . 0.0 110.261 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 69.3 mt -100.24 110.44 59.84 Favored Pre-proline 0 CA--C 1.554 1.115 0 CA-C-N 113.252 -1.795 . . . . 0.0 109.518 -176.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -52.04 -26.34 25.25 Favored 'Trans proline' 0 C--N 1.372 1.795 0 N-CA-C 117.918 2.238 . . . . 0.0 117.918 -174.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 p -65.52 -6.79 11.72 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 118.531 -1.268 . . . . 0.0 113.095 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -110.8 6.79 21.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.341 -177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -122.1 115.95 30.13 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.712 -178.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -68.52 -9.34 25.77 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-O 122.029 0.762 . . . . 0.0 112.219 161.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.407 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 9.1 t-20 -69.34 -167.1 0.11 Allowed 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 113.927 -1.488 . . . . 0.0 107.965 175.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -147.12 37.63 0.95 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 123.117 1.436 . . . . 0.0 108.315 177.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -71.17 -64.1 0.98 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 111.058 -2.792 . . . . 0.0 109.218 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.66 158.35 32.48 Favored 'General case' 0 C--N 1.346 0.456 0 C-N-CA 118.617 -1.233 . . . . 0.0 108.156 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.93 -142.2 0.15 Allowed 'General case' 0 C--N 1.345 0.381 0 CA-C-N 113.264 -1.789 . . . . 0.0 107.542 -175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -89.55 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.861 0 O-C-N 124.865 1.353 . . . . 0.0 108.093 175.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -127.45 -6.04 5.87 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.327 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 15.5 m-30 -44.55 139.16 2.95 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 114.897 -1.047 . . . . 0.0 112.771 -177.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.461 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.4 m -62.75 131.12 47.83 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 114.014 -1.448 . . . . 0.0 111.132 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -126.31 -173.71 2.93 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-O 122.224 1.011 . . . . 0.0 109.531 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.523 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 9.7 m120 -136.27 56.38 13.99 Favored Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 112.246 -2.252 . . . . 0.0 110.226 -176.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -57.44 -43.07 54.9 Favored 'Trans proline' 0 C--N 1.372 1.809 0 N-CA-C 114.834 1.052 . . . . 0.0 114.834 -178.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.564 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 10.2 p-10 -98.43 9.22 43.63 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.847 176.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.523 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.377 0.0 OUTLIER 34.26 67.94 0.2 Allowed 'General case' 0 C--N 1.348 0.536 0 CA-C-N 112.367 -2.197 . . . . 0.0 114.554 -177.094 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.673 ' OE1' ' H72' ' A' ' 84' ' ' AMH . 20.3 tt0 -74.26 173.84 9.63 Favored 'General case' 0 N--CA 1.441 -0.903 1 CA-C-N 108.0 -4.182 . . . . 0.0 105.33 172.305 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 47.2 tp -65.7 -77.06 0.07 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.553 1.158 . . . . 0.0 110.054 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -72.72 136.25 80.54 Favored Pre-proline 0 CA--C 1.552 1.021 0 CA-C-N 113.959 -1.473 . . . . 0.0 108.019 -178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.04 132.77 31.06 Favored 'Trans proline' 0 C--N 1.365 1.423 0 N-CA-C 107.728 -1.682 . . . . 0.0 107.728 -179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.48 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 62.9 p-90 -125.11 166.47 16.35 Favored 'General case' 0 C--N 1.347 0.493 0 CA-C-O 121.872 0.844 . . . . 0.0 110.918 -175.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -152.03 165.61 34.16 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 173.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -74.15 152.55 39.81 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 113.879 -1.51 . . . . 0.0 108.296 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.433 HG22 HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -101.06 169.48 8.91 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.9 p -78.29 -13.62 59.77 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.367 177.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.18 124.21 72.36 Favored Pre-proline 0 CA--C 1.551 0.999 0 O-C-N 124.036 0.835 . . . . 0.0 109.312 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -60.91 -7.47 7.79 Favored 'Trans proline' 0 C--N 1.366 1.497 0 N-CA-C 118.088 2.303 . . . . 0.0 118.088 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -99.16 -44.12 6.38 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-O 122.422 1.106 . . . . 0.0 108.112 -178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.546 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -90.26 82.48 5.99 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 113.482 -1.69 . . . . 0.0 106.703 178.176 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.614 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -51.13 -77.95 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.982 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 49.8 p-90 -101.87 156.63 17.4 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.817 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.546 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.0 tp10 -156.1 142.99 18.87 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 114.665 -1.152 . . . . 0.0 108.359 173.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' A' ' 62' ' ' TRP . 32.0 mt -73.03 143.37 47.54 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.057 178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.561 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 71.3 m -94.25 161.14 14.37 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 121.775 0.798 . . . . 0.0 111.701 178.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -107.06 111.13 23.46 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 105.994 -1.854 . . . . 0.0 105.994 172.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -113.13 144.53 31.32 Favored Pre-proline 0 CA--C 1.543 0.683 0 CA-C-N 113.164 -1.834 . . . . 0.0 106.634 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.66 120.28 6.97 Favored 'Trans proline' 0 C--N 1.362 1.254 0 C-N-CA 120.937 1.091 . . . . 0.0 111.391 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -75.23 133.91 41.27 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 112.988 -1.914 . . . . 0.0 107.476 176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 69.0 m -61.51 107.65 0.83 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 174.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 113.501 -1.681 . . . . 0.0 109.007 -174.022 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.673 ' H72' ' OE1' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 18.4 p . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.69 119.53 5.04 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 124.602 1.189 . . . . 0.0 111.359 179.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 54.58 25.26 6.12 Favored 'General case' 0 C--N 1.355 0.808 0 CA-C-N 113.96 -1.473 . . . . 0.0 111.585 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -139.0 110.54 7.04 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.566 -1.652 . . . . 0.0 112.41 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.3 p 170.51 167.64 0.07 Allowed 'General case' 0 N--CA 1.446 -0.643 0 CA-C-N 109.901 -3.318 . . . . 0.0 106.119 170.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.437 ' SD ' ' HB ' ' A' ' 77' ' ' ILE . 0.2 OUTLIER -119.66 123.55 44.12 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 124.533 1.146 . . . . 0.0 110.031 179.109 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.33 -34.86 68.37 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 112.606 -2.088 . . . . 0.0 107.419 167.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.69 -61.15 0.04 OUTLIER Glycine 0 CA--C 1.537 1.441 0 CA-C-N 112.071 -2.331 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.8 m -105.33 -9.44 17.61 Favored 'General case' 0 C--N 1.354 0.769 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 67.85 28.8 73.41 Favored Glycine 0 CA--C 1.537 1.469 0 C-N-CA 118.947 -1.597 . . . . 0.0 112.553 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.25 -37.29 74.62 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.504 -1.348 . . . . 0.0 112.276 -178.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -96.28 2.27 52.73 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 114.713 -1.131 . . . . 0.0 111.35 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.68 129.93 37.92 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.547 ' CG ' ' HZ2' ' A' ' 12' ' ' LYS . 6.1 p-10 -80.02 -36.51 35.71 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 118.239 -1.384 . . . . 0.0 114.706 -170.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 129.87 101.31 0.95 Allowed Glycine 0 CA--C 1.535 1.343 0 O-C-N 124.466 1.104 . . . . 0.0 110.763 -177.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.547 ' HZ2' ' CG ' ' A' ' 10' ' ' ASP . 36.8 mmtm -138.14 -19.85 1.12 Allowed 'General case' 0 CA--C 1.562 1.438 0 O-C-N 125.055 1.091 . . . . 0.0 111.557 175.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.49 138.92 48.58 Favored 'Isoleucine or valine' 0 C--N 1.354 0.792 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.0 t -134.21 21.5 3.74 Favored 'General case' 0 CA--C 1.545 0.767 0 O-C-N 125.028 1.455 . . . . 0.0 112.396 -177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.16 122.05 39.75 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 118.15 -1.42 . . . . 0.0 109.151 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 15.9 p -69.9 135.53 49.62 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.541 -1.663 . . . . 0.0 109.433 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.9 ptm -49.29 -41.26 37.52 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 112.21 -2.268 . . . . 0.0 113.23 -173.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.35 16.76 16.73 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.605 -176.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.11 -120.94 0.65 Allowed Glycine 0 CA--C 1.54 1.652 0 C-N-CA 115.993 -3.003 . . . . 0.0 115.247 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.54 176.18 5.23 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 113.462 -1.369 . . . . 0.0 114.152 -163.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.2 tp10 -75.27 133.74 41.26 Favored 'General case' 0 C--N 1.349 0.576 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 170.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.42 ' HB2' ' OG ' ' A' ' 14' ' ' SER . 4.6 m -76.32 162.37 27.96 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 124.821 2.248 . . . . 0.0 113.624 -176.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.49 138.6 31.29 Favored 'General case' 0 N--CA 1.445 -0.714 1 CA-C-N 108.374 -4.012 . . . . 0.0 107.348 179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 148.35 44.22 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 114.054 -1.43 . . . . 0.0 112.507 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -70.39 1.57 4.85 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -175.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -89.51 -131.81 0.09 Allowed 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 117.519 -1.672 . . . . 0.0 107.995 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -130.87 117.18 18.92 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -143.76 -62.32 0.39 Allowed 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 112.015 -2.357 . . . . 0.0 110.118 -174.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -177.28 172.7 0.78 Allowed Pre-proline 0 CA--C 1.544 0.719 0 N-CA-C 103.345 -2.835 . . . . 0.0 103.345 -177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -63.76 -16.2 5.43 Favored 'Cis proline' 0 C--N 1.369 1.636 0 O-C-N 123.802 1.422 . . . . 0.0 114.524 -13.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 62.3 t-80 -165.75 159.96 16.72 Favored 'General case' 0 C--N 1.346 0.448 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.33 107.36 3.26 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 124.797 1.311 . . . . 0.0 107.879 175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -95.55 -170.49 2.17 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 113.528 -1.669 . . . . 0.0 108.603 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -94.64 -173.71 38.21 Favored Glycine 0 CA--C 1.535 1.313 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.377 178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 55.9 56.94 5.54 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.867 0.841 . . . . 0.0 110.956 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.6 mt -100.69 125.39 38.99 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 113.718 -1.583 . . . . 0.0 107.793 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -58.04 -22.08 53.67 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 122.001 1.801 . . . . 0.0 114.371 -170.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.18 -9.83 26.42 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 113.438 -1.71 . . . . 0.0 113.186 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -109.62 2.96 20.6 Favored 'General case' 0 C--N 1.352 0.685 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.818 177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.406 ' HA ' ' HD2' ' A' ' 42' ' ' PRO . 89.8 m-85 -118.56 113.45 36.55 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.41 -176.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 41' ' ' PHE . 36.6 Cg_endo -67.93 -10.97 30.56 Favored 'Trans proline' 0 C--N 1.367 1.544 0 CA-C-O 122.118 0.799 . . . . 0.0 111.938 162.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -69.95 -167.28 0.15 Allowed 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 113.716 -1.583 . . . . 0.0 107.405 174.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.93 34.94 1.01 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 123.014 1.387 . . . . 0.0 108.729 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -61.74 -73.94 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 111.503 -2.59 . . . . 0.0 109.394 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 171.39 1.53 Allowed 'General case' 0 C--N 1.352 0.716 0 C-N-CA 119.595 -0.842 . . . . 0.0 109.064 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.23 -140.38 0.11 Allowed 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.026 -1.472 . . . . 0.0 107.026 -179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -65.85 -80.41 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 119.039 -1.064 . . . . 0.0 108.866 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.2 p-10 -128.51 -16.83 4.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 114.03 -1.441 . . . . 0.0 110.095 175.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -49.01 135.85 15.27 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 113.696 -1.593 . . . . 0.0 112.395 -177.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 6.0 m -60.93 152.85 26.49 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 112.98 -1.918 . . . . 0.0 114.419 -174.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -146.8 -170.48 3.54 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 112.661 -2.063 . . . . 0.0 109.295 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.583 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 16.9 m120 -134.58 59.75 37.95 Favored Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 112.35 -2.205 . . . . 0.0 110.183 -175.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_exo -58.56 -45.01 32.54 Favored 'Trans proline' 0 C--N 1.368 1.567 0 CA-C-O 122.449 0.937 . . . . 0.0 114.281 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.627 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 7.2 p-10 -97.04 3.45 51.86 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 112.144 -2.298 . . . . 0.0 110.038 176.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.583 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.426 0.0 OUTLIER 44.41 70.09 0.36 Allowed 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 112.345 -2.207 . . . . 0.0 113.843 -176.538 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.567 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 6.3 tp10 -68.3 162.38 25.27 Favored 'General case' 0 N--CA 1.443 -0.789 1 CA-C-N 108.098 -4.137 . . . . 0.0 107.338 174.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.7 tt -52.88 -50.44 63.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 113.379 -1.737 . . . . 0.0 111.005 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 ttm-85 -112.27 146.6 35.22 Favored Pre-proline 0 CA--C 1.554 1.105 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.34 137.12 33.06 Favored 'Trans proline' 0 C--N 1.366 1.488 0 N-CA-C 108.605 -1.344 . . . . 0.0 108.605 179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 68.1 p-90 -125.2 173.38 8.81 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-O 121.972 0.891 . . . . 0.0 110.886 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 4.3 p -150.95 167.43 27.62 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 112.599 -2.091 . . . . 0.0 106.767 175.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -80.5 137.04 36.41 Favored 'General case' 0 C--N 1.35 0.602 0 CA-C-N 113.843 -1.526 . . . . 0.0 106.956 176.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -88.81 175.26 7.55 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 117.72 -1.592 . . . . 0.0 110.481 -174.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.8 p -88.25 -10.71 48.79 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 112.965 -1.925 . . . . 0.0 110.481 176.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -83.67 121.26 76.22 Favored Pre-proline 0 CA--C 1.547 0.837 0 O-C-N 124.001 0.813 . . . . 0.0 109.12 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -58.67 -5.28 2.39 Favored 'Trans proline' 0 C--N 1.367 1.514 0 N-CA-C 116.769 1.796 . . . . 0.0 116.769 171.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -114.15 6.95 16.49 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.916 0.389 . . . . 0.0 110.663 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.03 94.98 3.12 Favored 'General case' 0 C--N 1.35 0.606 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 174.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.495 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.6 tmm_? -66.13 -80.15 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 118.594 -1.242 . . . . 0.0 109.917 -178.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 53.7 p-90 -96.17 150.26 20.72 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 175.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -156.37 142.71 18.34 Favored 'General case' 0 C--N 1.351 0.649 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 174.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.3 mt -68.38 141.7 55.66 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.727 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.58 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 60.4 m -96.27 173.37 7.43 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 114.073 -1.421 . . . . 0.0 110.857 177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -124.17 114.76 20.07 Favored 'General case' 0 C--N 1.347 0.485 0 CA-C-N 113.369 -1.741 . . . . 0.0 106.973 171.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.437 ' HB ' ' SD ' ' A' ' 2' ' ' MET . 1.0 OUTLIER -114.19 141.7 26.81 Favored Pre-proline 0 CA--C 1.543 0.685 0 N-CA-C 105.223 -2.14 . . . . 0.0 105.223 -176.706 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.83 125.81 18.12 Favored 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 121.605 1.536 . . . . 0.0 112.039 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 52.4 ttp180 -62.61 148.59 45.74 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.065 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 62.9 m -75.19 66.03 1.64 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.582 -1.19 . . . . 0.0 111.287 177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.7 p . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 178.464 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.627 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.443 -0.795 0 CA-C-O 121.863 0.84 . . . . 0.0 111.114 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 38.7 m -165.88 37.62 0.05 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 113.237 -1.802 . . . . 0.0 108.228 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 45.5 47.22 11.08 Favored 'General case' 0 C--N 1.351 0.636 0 CA-C-N 112.239 -2.255 . . . . 0.0 110.688 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.1 -35.3 21.9 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 111.698 -2.501 . . . . 0.0 113.115 -174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 8.5 p -112.75 143.3 44.21 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 119.844 -0.742 . . . . 0.0 109.124 179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -125.37 168.49 13.49 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 113.332 -1.758 . . . . 0.0 107.922 -177.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -67.19 -34.42 77.48 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 113.536 -1.665 . . . . 0.0 110.066 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.46 -20.28 0.92 Allowed Glycine 0 C--N 1.351 1.416 0 CA-C-N 113.584 -1.643 . . . . 0.0 112.968 178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.9 p -86.43 -48.59 8.29 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.66 0.743 . . . . 0.0 111.852 -176.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 92.11 9.59 61.98 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 113.889 -1.505 . . . . 0.0 113.687 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 56' ' ' ARG . 7.7 tp10 -56.9 -39.58 74.67 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 118.468 -1.293 . . . . 0.0 112.412 -179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -94.1 5.67 50.99 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.662 -1.154 . . . . 0.0 111.657 -178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -77.25 135.41 38.45 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.814 -178.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -159.41 37.25 0.2 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 112.918 -1.946 . . . . 0.0 108.283 169.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.13 -109.04 0.12 Allowed Glycine 0 C--N 1.348 1.244 0 CA-C-N 114.769 -1.105 . . . . 0.0 113.861 -173.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -144.27 -17.46 0.56 Allowed 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -171.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 mp -70.67 134.36 30.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 C-N-CA 119.192 -1.003 . . . . 0.0 108.437 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.412 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 6.2 t -144.77 39.95 1.26 Allowed 'General case' 0 CA--C 1.546 0.812 0 O-C-N 125.658 1.849 . . . . 0.0 111.264 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.439 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 13.9 mptt -118.31 128.04 54.29 Favored 'General case' 0 C--N 1.347 0.474 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.4 p -77.03 129.08 35.6 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.436 -1.711 . . . . 0.0 109.176 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 19.6 ptm -48.82 -23.88 1.23 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 111.948 -2.387 . . . . 0.0 115.197 -171.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.4 t -137.58 34.96 2.46 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 123.862 0.726 . . . . 0.0 110.983 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.26 -89.88 0.08 OUTLIER Glycine 0 C--N 1.357 1.736 1 C-N-CA 113.759 -4.067 . . . . 0.0 118.089 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.3 mt -132.41 176.63 8.26 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 123.14 1.448 . . . . 0.0 113.498 -162.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.439 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.1 tp10 -75.59 135.03 40.54 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 111.465 -2.607 . . . . 0.0 104.79 170.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 1.7 m -77.4 151.17 34.93 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 124.139 1.923 . . . . 0.0 111.665 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.14 134.94 34.12 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 109.589 -3.46 . . . . 0.0 106.898 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.56 149.65 38.41 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.873 -1.512 . . . . 0.0 112.755 -176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -71.93 2.23 5.91 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 113.647 -1.615 . . . . 0.0 112.57 179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -73.65 -131.8 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -146.25 118.67 8.45 Favored 'General case' 0 C--N 1.345 0.377 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -147.38 -70.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.135 -172.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 m -172.49 168.91 2.73 Favored Pre-proline 0 CA--C 1.543 0.704 0 N-CA-C 103.614 -2.736 . . . . 0.0 103.614 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -64.17 -15.67 5.73 Favored 'Cis proline' 0 C--N 1.367 1.531 0 N-CA-C 115.481 1.3 . . . . 0.0 115.481 -7.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -166.23 166.47 16.84 Favored 'General case' 0 C--N 1.348 0.516 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.67 79.22 2.64 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 125.051 1.469 . . . . 0.0 110.151 178.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -66.16 168.78 7.96 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 112.375 -2.193 . . . . 0.0 110.76 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.9 179.35 51.4 Favored Glycine 0 CA--C 1.536 1.364 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 64.4 71.61 0.47 Allowed 'General case' 0 CA--C 1.543 0.694 0 O-C-N 124.45 0.735 . . . . 0.0 111.162 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 65.8 mt -120.3 130.54 24.8 Favored Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -59.11 -20.35 53.7 Favored 'Trans proline' 0 C--N 1.369 1.654 0 N-CA-C 116.323 1.624 . . . . 0.0 116.323 -169.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.4 p -68.03 -10.79 56.49 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 178.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -103.19 -0.3 30.66 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 123.919 0.762 . . . . 0.0 110.293 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 97.2 m-85 -121.0 112.14 33.62 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.131 -0.94 . . . . 0.0 108.972 -178.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -61.37 -39.15 59.02 Favored 'Trans proline' 0 C--N 1.37 1.66 0 N-CA-C 108.462 -1.399 . . . . 0.0 108.462 164.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -56.52 142.43 39.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.532 -2.122 . . . . 0.0 106.99 171.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -107.15 70.1 0.78 Allowed 'General case' 0 C--O 1.222 -0.393 0 CA-C-O 122.752 1.263 . . . . 0.0 109.334 -175.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.8 p-10 -83.64 -65.39 1.02 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 111.203 -2.726 . . . . 0.0 108.486 176.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.38 135.19 39.49 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.089 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -115.85 -126.06 0.29 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 106.127 -1.805 . . . . 0.0 106.127 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.7 mmmt -82.28 -92.78 0.06 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 119.006 -1.078 . . . . 0.0 109.896 178.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -116.76 -6.83 11.54 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.533 0.683 . . . . 0.0 110.863 176.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -52.93 131.11 35.37 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.98 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.453 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.9 m -58.56 159.02 6.91 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.418 -175.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.9 mmm180 -147.97 -179.62 7.05 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 123.274 1.512 . . . . 0.0 109.449 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -127.66 76.2 77.25 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-N 108.939 -3.755 . . . . 0.0 105.229 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -73.59 -44.71 0.48 Allowed 'Trans proline' 0 C--N 1.37 1.692 0 CA-C-O 122.66 1.025 . . . . 0.0 112.522 171.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.708 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 1.7 p30 -108.24 17.15 22.55 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 111.981 -2.372 . . . . 0.0 110.034 177.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER 24.69 76.77 0.02 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 112.139 -2.301 . . . . 0.0 115.073 175.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -150.24 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 109.469 -3.514 . . . . 0.0 108.704 174.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 61.0 tp -75.67 -78.85 0.1 Allowed 'General case' 0 CA--C 1.553 1.085 0 CA-C-N 113.718 -1.583 . . . . 0.0 110.72 175.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -108.43 136.14 19.92 Favored Pre-proline 0 CA--C 1.553 1.08 0 CA-C-N 114.095 -1.411 . . . . 0.0 108.453 -178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.07 133.69 53.09 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.788 2.325 . . . . 0.0 113.649 -167.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 61.6 p-90 -112.63 171.64 7.4 Favored 'General case' 0 C--N 1.353 0.733 0 CA-C-O 122.466 1.127 . . . . 0.0 111.444 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.7 p -158.29 165.93 33.57 Favored 'General case' 0 C--N 1.346 0.452 0 CA-C-N 112.207 -2.269 . . . . 0.0 106.8 173.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -77.28 155.7 31.9 Favored 'General case' 0 C--N 1.349 0.546 0 CA-C-N 113.638 -1.619 . . . . 0.0 108.007 178.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.69 172.87 6.57 Favored 'General case' 0 C--N 1.345 0.39 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 17.9 p -80.88 -13.62 58.76 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 113.66 -1.609 . . . . 0.0 111.76 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -81.73 127.91 70.96 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.746 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.48 -3.74 1.0 Allowed 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 119.488 2.841 . . . . 0.0 119.488 175.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -118.45 -38.15 3.2 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -85.91 84.36 7.56 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 177.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -78.26 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 113.258 -1.792 . . . . 0.0 112.013 -178.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.432 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 27.3 p-90 -105.04 167.6 9.6 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.063 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -169.98 150.1 3.76 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-N 113.68 -1.6 . . . . 0.0 109.445 173.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.5 mt -72.82 142.59 48.02 Favored 'General case' 0 C--N 1.352 0.679 0 CA-C-N 113.396 -1.729 . . . . 0.0 108.771 177.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.7 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 94.6 m -93.3 158.67 15.63 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.33 177.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.22 92.66 5.31 Favored 'General case' 0 C--N 1.352 0.707 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.19 175.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -96.67 136.97 21.48 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -77.0 127.73 9.51 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 121.805 1.67 . . . . 0.0 110.987 179.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 60.1 ttp85 -72.12 148.82 45.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 117.794 -1.562 . . . . 0.0 108.545 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.95 118.97 12.54 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 173.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 CA--C 1.537 0.446 0 CA-C-N 113.799 -1.546 . . . . 0.0 108.079 -177.915 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.708 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 121.258 0.551 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.442 ' O ' ' NZ ' ' A' ' 12' ' ' LYS . 95.3 p -48.76 96.27 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.015 -1.448 . . . . 0.0 114.319 -178.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 62.55 27.73 16.37 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.153 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -100.22 -6.79 25.52 Favored 'General case' 0 C--N 1.349 0.583 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 3.6 p -112.31 136.68 51.46 Favored 'General case' 0 C--N 1.354 0.764 0 C-N-CA 118.676 -1.209 . . . . 0.0 108.61 176.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.4 mpp? -133.62 -175.88 3.97 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 113.796 -1.547 . . . . 0.0 108.965 -176.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -75.2 -31.06 60.81 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 112.579 -2.101 . . . . 0.0 109.553 172.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 149.15 -32.81 1.14 Allowed Glycine 0 C--N 1.352 1.448 0 CA-C-N 113.994 -1.457 . . . . 0.0 112.75 178.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 p -92.01 -36.12 13.57 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-O 121.753 0.787 . . . . 0.0 112.314 -175.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 61.31 64.65 3.85 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 118.972 -1.585 . . . . 0.0 114.117 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.26 -59.02 4.91 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-O 122.942 1.353 . . . . 0.0 110.767 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 44' ' ' LYS . 52.6 t30 -95.12 6.16 49.83 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 112.992 -1.913 . . . . 0.0 111.112 -178.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -55.46 121.86 9.95 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.758 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.6 p30 -128.51 11.9 6.35 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 112.774 -2.012 . . . . 0.0 113.13 -178.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.87 -153.25 0.82 Allowed Glycine 0 N--CA 1.432 -1.632 0 CA-C-O 123.087 1.382 . . . . 0.0 112.442 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' O ' ' A' ' -3' ' ' SER . 31.8 mmtm -108.75 -7.81 15.5 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 109.461 -3.369 . . . . 0.0 118.191 -161.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.425 HG22 ' H ' ' A' ' 15' ' ' LYS . 3.2 mp -71.77 133.33 32.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 C-N-CA 116.833 -1.947 . . . . 0.0 108.967 -178.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 3.5 t -130.2 23.69 5.22 Favored 'General case' 0 CA--C 1.56 1.334 0 O-C-N 126.751 2.532 . . . . 0.0 110.809 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.425 ' H ' HG22 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -103.67 122.04 44.21 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.632 -174.101 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.9 p -73.74 129.28 37.6 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 178.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -49.04 -33.53 11.56 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 112.85 -1.977 . . . . 0.0 114.276 -172.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.3 22.43 13.28 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.592 -175.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 171.48 -90.53 0.09 OUTLIER Glycine 0 C--N 1.36 1.905 1 C-N-CA 112.847 -4.501 . . . . 0.0 119.349 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.9 mt -78.62 177.34 8.68 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 110.642 -2.779 . . . . 0.0 113.53 -162.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -107.83 137.02 46.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 110.934 -2.848 . . . . 0.0 103.949 172.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 35.6 m -70.24 148.0 49.09 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 123.933 1.825 . . . . 0.0 112.002 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.98 136.87 32.79 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 109.689 -3.414 . . . . 0.0 104.622 176.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.11 150.91 28.14 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.634 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -68.84 6.07 0.97 Allowed 'General case' 0 CA--C 1.55 0.95 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -80.79 -139.83 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 118.579 0.627 . . . . 0.0 110.815 -178.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.7 t -139.15 108.98 6.28 Favored 'General case' 0 C--N 1.349 0.585 0 N-CA-C 105.697 -1.964 . . . . 0.0 105.697 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.89 -78.83 0.25 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 112.286 -2.233 . . . . 0.0 112.161 -168.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.0 m 176.75 152.51 0.38 Allowed Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 128.365 2.666 . . . . 0.0 103.872 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -70.89 -15.05 14.43 Favored 'Cis proline' 0 C--N 1.366 1.488 0 N-CA-C 118.259 2.369 . . . . 0.0 118.259 7.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.65 151.94 6.59 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.269 -1.372 . . . . 0.0 109.712 178.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.66 79.55 1.52 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 113.338 -1.755 . . . . 0.0 110.697 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -69.07 170.78 9.29 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 113.082 -1.872 . . . . 0.0 109.885 177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.72 -162.88 19.21 Favored Glycine 0 C--N 1.353 1.486 0 N-CA-C 109.598 -1.401 . . . . 0.0 109.598 177.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 66.34 63.44 0.54 Allowed 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 107.229 -1.397 . . . . 0.0 107.229 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 87.7 mt -87.81 111.93 45.56 Favored Pre-proline 0 CA--C 1.548 0.878 0 CA-C-N 112.672 -2.058 . . . . 0.0 111.333 -169.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -55.77 -20.59 29.06 Favored 'Trans proline' 0 C--N 1.37 1.686 0 N-CA-C 116.949 1.865 . . . . 0.0 116.949 -173.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -61.72 -17.44 55.76 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.806 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -104.59 -0.39 27.72 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.962 -179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -124.26 84.74 55.78 Favored Pre-proline 0 CA--C 1.545 0.778 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.497 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.5 -14.11 42.46 Favored 'Trans proline' 0 C--N 1.369 1.643 0 O-C-N 122.85 0.921 . . . . 0.0 111.103 161.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -59.08 158.13 9.18 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 112.957 -1.928 . . . . 0.0 107.449 171.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 8' ' ' ASN . 0.2 OUTLIER -84.5 2.4 41.22 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.199 -0.91 . . . . 0.0 113.091 -174.166 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.1 p-10 -65.53 -86.63 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.583 -1.19 . . . . 0.0 111.758 -179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.42 105.38 5.54 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 -177.308 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.439 ' HD3' ' HA ' ' A' ' 47' ' ' LYS 0.256 0.8 OUTLIER -127.38 -93.01 0.47 Allowed 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 113.362 -1.744 . . . . 0.0 110.933 -176.802 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -92.15 -112.45 0.09 Allowed 'General case' 0 C--N 1.353 0.749 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -120.71 11.31 11.18 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-O 122.12 0.962 . . . . 0.0 110.287 176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -64.94 136.79 57.23 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 113.503 -1.68 . . . . 0.0 110.687 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.2 m -65.08 147.9 52.64 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.266 176.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -140.43 -170.94 3.1 Favored 'General case' 0 C--N 1.348 0.53 0 O-C-N 126.124 2.14 . . . . 0.0 105.682 -178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -142.51 61.59 11.71 Favored Pre-proline 0 CA--C 1.544 0.723 0 O-C-N 124.502 1.127 . . . . 0.0 110.083 174.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.01 -37.71 94.83 Favored 'Trans proline' 0 C--N 1.367 1.531 0 N-CA-C 115.806 1.425 . . . . 0.0 115.806 -171.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.579 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.5 p-10 -95.26 -5.38 43.84 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.238 178.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.47 0.0 OUTLIER 52.44 64.61 1.79 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 127.885 2.474 . . . . 0.0 113.376 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.674 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 7.0 tp10 -66.32 168.63 8.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 108.788 -3.824 . . . . 0.0 105.868 171.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.46 -62.86 1.38 Allowed 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.855 0.836 . . . . 0.0 110.948 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -98.99 146.69 32.1 Favored Pre-proline 0 CA--C 1.554 1.134 0 CA-C-N 112.918 -1.946 . . . . 0.0 107.83 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -70.73 138.62 35.14 Favored 'Trans proline' 0 C--N 1.366 1.468 0 C-N-CA 121.773 1.648 . . . . 0.0 109.15 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.47 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 61.0 p-90 -130.83 177.34 7.49 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.377 1.084 . . . . 0.0 111.253 -175.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.674 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.9 OUTLIER -160.67 168.31 25.16 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 112.21 -2.268 . . . . 0.0 106.479 173.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -74.65 146.81 42.08 Favored 'General case' 0 C--N 1.351 0.668 0 CA-C-N 114.432 -1.258 . . . . 0.0 107.955 178.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -94.0 177.15 6.07 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 119.169 -1.013 . . . . 0.0 109.426 -177.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.1 p -92.18 -7.23 48.93 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 113.044 -1.889 . . . . 0.0 111.037 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.42 130.77 60.7 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.806 -179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -56.58 -5.46 1.16 Allowed 'Trans proline' 0 C--N 1.366 1.468 0 N-CA-C 120.009 3.042 . . . . 0.0 120.009 177.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -121.89 -32.21 3.79 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 120.684 -0.406 . . . . 0.0 110.69 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 tptm -88.41 96.01 10.43 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 118.541 -1.264 . . . . 0.0 108.745 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.596 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 30.5 ttt180 -57.18 -80.55 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 113.479 -1.691 . . . . 0.0 111.188 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.403 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 41.7 p-90 -100.72 163.51 12.3 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.124 0.964 . . . . 0.0 111.12 -179.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -163.51 142.39 8.09 Favored 'General case' 0 C--N 1.348 0.518 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.157 173.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 67.9 mt -69.46 136.07 51.03 Favored 'General case' 0 C--N 1.349 0.57 0 CA-C-N 113.091 -1.868 . . . . 0.0 108.632 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.423 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 160.83 15.55 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.284 178.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -106.0 111.08 23.57 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-N 113.592 -1.64 . . . . 0.0 106.773 173.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -109.77 138.39 20.67 Favored Pre-proline 0 CA--C 1.548 0.886 0 CA-C-N 113.043 -1.89 . . . . 0.0 106.691 -177.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.2 128.95 11.73 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 121.704 1.603 . . . . 0.0 111.516 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -70.29 146.73 50.38 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.858 176.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.1 m -69.54 90.0 0.54 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.451 175.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.3 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 114.413 -1.267 . . . . 0.0 108.756 179.697 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.674 ' H72' ' OE2' ' A' ' 57' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.41 ' H ' ' CG ' ' A' ' 10' ' ' ASP . 32.1 t 72.43 63.28 0.12 Allowed 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.67 1.231 . . . . 0.0 109.895 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -156.31 150.4 25.28 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 113.827 -1.533 . . . . 0.0 108.62 -174.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -91.97 -55.24 3.53 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.051 -1.431 . . . . 0.0 114.045 -174.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.2 p -91.76 150.44 21.1 Favored 'General case' 0 C--N 1.346 0.44 0 O-C-N 123.975 0.797 . . . . 0.0 108.866 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.2 mmt -130.76 179.86 5.72 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 122.673 1.225 . . . . 0.0 109.13 179.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -64.73 -29.17 70.15 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 112.066 -2.333 . . . . 0.0 111.057 176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.76 -50.04 0.43 Allowed Glycine 0 C--N 1.354 1.541 0 C-N-CA 118.917 -1.611 . . . . 0.0 113.89 177.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.2 p -81.75 -14.75 56.05 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -171.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 71.83 18.8 77.75 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 118.06 -2.019 . . . . 0.0 115.099 176.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.76 -35.0 73.71 Favored 'General case' 0 CA--C 1.553 1.081 0 CA-C-O 122.981 1.372 . . . . 0.0 111.548 179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.82 20.84 18.26 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 112.781 -2.009 . . . . 0.0 110.017 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -78.64 118.21 20.52 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 118.659 -1.217 . . . . 0.0 112.695 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.41 ' CG ' ' H ' ' A' ' -3' ' ' SER . 22.2 p-10 -156.39 88.61 1.08 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 112.57 -2.105 . . . . 0.0 108.321 170.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 -114.26 1.84 Allowed Glycine 0 C--N 1.353 1.489 0 CA-C-N 113.45 -1.704 . . . . 0.0 109.257 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -138.79 -8.71 1.4 Allowed 'General case' 0 CA--C 1.547 0.848 0 O-C-N 125.057 1.092 . . . . 0.0 113.384 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.17 133.8 31.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.4 t -150.47 42.75 0.83 Allowed 'General case' 0 CA--C 1.54 0.573 0 O-C-N 125.556 1.785 . . . . 0.0 110.247 177.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.437 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 14.0 mptt -119.05 131.48 55.97 Favored 'General case' 0 C--N 1.344 0.331 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 -178.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 2.1 p -69.07 136.92 53.05 Favored 'General case' 0 C--N 1.349 0.561 0 CA-C-N 113.858 -1.519 . . . . 0.0 107.016 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 ptp -39.81 -31.12 0.1 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 111.858 -2.428 . . . . 0.0 114.737 -171.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.6 m -154.43 48.83 0.6 Allowed 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 118.629 -1.228 . . . . 0.0 110.041 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -159.12 -77.13 0.02 OUTLIER Glycine 0 C--N 1.356 1.66 0 C-N-CA 114.532 -3.699 . . . . 0.0 117.89 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.8 mt -134.62 167.24 21.17 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 122.456 1.122 . . . . 0.0 113.655 -164.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.437 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 4.6 tp10 -79.17 132.65 36.61 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 169.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 10.0 m -76.13 155.82 34.33 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 123.718 1.723 . . . . 0.0 111.869 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.467 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.0 OUTLIER -91.1 136.3 33.18 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 110.503 -3.044 . . . . 0.0 105.755 177.52 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.74 156.23 24.3 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.281 -1.327 . . . . 0.0 112.846 -175.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 94.4 m95 -73.76 8.07 2.15 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -79.12 -133.97 0.02 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.122 0.486 . . . . 0.0 110.169 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.1 t -147.14 107.52 4.07 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.32 -80.57 0.27 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 112.7 -2.046 . . . . 0.0 112.563 -169.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.7 p -178.47 145.89 0.51 Allowed Pre-proline 0 N--CA 1.447 -0.607 0 N-CA-C 104.242 -2.503 . . . . 0.0 104.242 -175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -75.0 -12.66 23.94 Favored 'Cis proline' 0 C--N 1.364 1.359 0 N-CA-C 118.607 2.503 . . . . 0.0 118.607 10.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -166.51 153.47 9.25 Favored 'General case' 0 C--N 1.352 0.677 0 C-N-CA 118.551 -1.259 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.23 77.15 2.35 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 113.783 -1.553 . . . . 0.0 110.299 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' HE22 ' A' ' 23' ' ' GLN . 20.7 p80 -68.97 170.51 9.66 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 112.46 -2.154 . . . . 0.0 110.696 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.92 -168.6 41.55 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 114.497 -1.229 . . . . 0.0 110.126 177.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 60.83 56.01 3.04 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-O 121.76 0.79 . . . . 0.0 109.89 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 55.5 mt -104.32 129.67 24.68 Favored Pre-proline 0 CA--C 1.54 0.584 0 CA-C-N 113.656 -1.611 . . . . 0.0 107.713 -176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -55.62 -23.25 39.43 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.598 1.532 . . . . 0.0 115.212 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.1 m -61.85 -15.32 41.23 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.731 178.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -104.94 3.76 31.1 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.487 -179.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -122.9 114.95 29.46 Favored Pre-proline 0 CA--C 1.537 0.477 0 O-C-N 123.992 0.807 . . . . 0.0 110.746 -177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -73.49 -5.02 16.41 Favored 'Trans proline' 0 C--N 1.366 1.453 0 O-C-N 122.455 0.713 . . . . 0.0 112.13 159.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -74.78 161.1 29.91 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 114.286 -1.324 . . . . 0.0 107.926 177.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.31 52.5 1.03 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . 0.256 44.6 p-10 -95.06 -98.84 0.16 Allowed 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.228 -179.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.94 136.91 51.52 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 122.144 0.973 . . . . 0.0 111.679 -173.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -132.03 -121.96 0.2 Allowed 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.861 -1.972 . . . . 0.0 107.797 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 mmtp -71.17 -102.4 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.759 0 O-C-N 124.173 0.921 . . . . 0.0 108.574 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.0 p-10 -116.61 -9.29 11.38 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.599 0.714 . . . . 0.0 110.761 176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -46.86 124.1 5.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.115 -178.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 4.5 m -54.09 155.86 3.35 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 113.667 -1.606 . . . . 0.0 112.232 -176.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -142.79 -174.87 4.28 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 126.449 2.343 . . . . 0.0 105.31 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -143.14 67.19 16.99 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.262 174.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -57.79 -41.14 72.88 Favored 'Trans proline' 0 C--N 1.367 1.538 0 N-CA-C 115.536 1.322 . . . . 0.0 115.536 -174.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.565 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 8.9 p-10 -96.67 1.19 50.79 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 112.988 -1.915 . . . . 0.0 109.885 177.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.482 0.0 OUTLIER 42.51 69.46 0.37 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 112.081 -2.327 . . . . 0.0 114.196 -176.974 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.452 ' OE1' ' C7 ' ' A' ' 84' ' ' AMH . 14.5 tp10 -67.49 173.33 4.18 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 108.751 -3.84 . . . . 0.0 107.135 173.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 55.0 tp -54.99 -59.24 5.01 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 121.958 0.885 . . . . 0.0 111.662 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.446 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.0 OUTLIER -103.18 146.65 32.84 Favored Pre-proline 0 CA--C 1.557 1.225 0 CA-C-N 113.269 -1.787 . . . . 0.0 107.344 179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 38.2 Cg_endo -64.64 142.59 77.86 Favored 'Trans proline' 0 C--N 1.369 1.626 0 C-N-CA 121.759 1.639 . . . . 0.0 110.325 175.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -130.7 173.63 10.72 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 122.471 1.129 . . . . 0.0 112.092 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.8 p -155.07 167.28 30.87 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.83 -2.441 . . . . 0.0 106.677 174.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -80.28 153.87 28.19 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.369 -1.287 . . . . 0.0 107.983 178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.89 172.14 6.94 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 122.152 0.977 . . . . 0.0 109.241 -179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -82.68 -12.51 57.55 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 113.011 -1.904 . . . . 0.0 111.602 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -77.59 128.09 80.77 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.205 -176.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo -56.77 -5.03 1.04 Allowed 'Trans proline' 0 C--N 1.367 1.504 0 N-CA-C 119.286 2.764 . . . . 0.0 119.286 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -120.2 -37.72 3.03 Favored 'General case' 0 C--N 1.345 0.382 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.18 82.92 7.87 Favored 'General case' 0 C--N 1.347 0.477 0 C-N-CA 118.285 -1.366 . . . . 0.0 108.126 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.46 HH12 ' C8 ' ' A' ' 84' ' ' AMH . 2.5 tmm_? -57.76 -78.83 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 112.907 -1.952 . . . . 0.0 111.689 -178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 48.6 p-90 -95.4 155.69 16.63 Favored 'General case' 0 C--N 1.351 0.643 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.029 178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -163.02 145.01 10.13 Favored 'General case' 0 C--N 1.351 0.631 0 C-N-CA 118.518 -1.273 . . . . 0.0 110.137 173.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 68.7 mt -68.5 137.01 54.06 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 112.577 -2.101 . . . . 0.0 109.893 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.692 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 80.6 m -90.4 169.99 10.6 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 113.04 -1.891 . . . . 0.0 107.326 174.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -120.28 109.15 15.04 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 117.268 -1.773 . . . . 0.0 107.807 168.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -100.94 133.67 20.91 Favored Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -67.45 136.51 39.98 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 121.919 1.746 . . . . 0.0 112.29 -172.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -70.93 131.58 43.94 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 113.296 -1.775 . . . . 0.0 107.256 175.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.5 m -70.5 94.17 0.95 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 118.151 -1.42 . . . . 0.0 109.872 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 114.241 -1.345 . . . . 0.0 108.51 179.039 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.565 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . 0.519 HG22 ' H ' ' A' ' -3' ' ' SER . 3.1 m . . . . . 0 N--CA 1.441 -0.917 0 N-CA-C 102.992 -2.966 . . . . 0.0 102.992 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.519 ' H ' HG22 ' A' ' -4' ' ' THR . 0.4 OUTLIER -44.04 119.21 1.68 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 125.392 1.683 . . . . 0.0 113.576 -177.394 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 40.36 53.22 2.93 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 113.233 -1.803 . . . . 0.0 112.898 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.91 30.83 0.08 Allowed 'General case' 0 CA--C 1.555 1.168 0 N-CA-C 116.377 1.991 . . . . 0.0 116.377 -173.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.2 p -166.88 137.6 3.18 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 106.26 -1.756 . . . . 0.0 106.26 173.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.3 mpp? -132.97 174.21 10.59 Favored 'General case' 0 C--N 1.346 0.421 0 O-C-N 124.797 1.311 . . . . 0.0 109.247 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -81.91 -50.08 9.58 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 112.351 -2.204 . . . . 0.0 107.463 170.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 162.92 48.28 0.02 OUTLIER Glycine 0 C--N 1.35 1.318 0 CA-C-N 112.713 -2.039 . . . . 0.0 111.286 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.0 p -137.26 -70.92 0.44 Allowed 'General case' 0 C--N 1.35 0.59 0 CA-C-O 122.814 1.292 . . . . 0.0 110.172 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 75.9 34.23 48.5 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 113.686 -1.597 . . . . 0.0 112.362 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 56' ' ' ARG . 8.7 tp10 -56.43 -44.39 80.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.888 -1.656 . . . . 0.0 110.648 178.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -93.58 -25.89 17.34 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 114.365 -1.289 . . . . 0.0 112.228 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.417 ' O ' ' NH1' ' A' ' 52' ' ' ARG . 32.9 t80 -48.75 110.74 0.38 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -174.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.435 ' CG ' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -141.36 68.36 1.34 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 113.793 -1.549 . . . . 0.0 107.903 166.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.32 -95.78 1.61 Allowed Glycine 0 C--N 1.35 1.334 0 CA-C-N 112.695 -2.048 . . . . 0.0 113.716 -175.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -143.78 -12.64 0.66 Allowed 'General case' 0 C--N 1.355 0.831 0 N-CA-C 117.27 2.322 . . . . 0.0 117.27 -172.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 mp -92.96 137.72 21.74 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 O-C-N 124.438 1.086 . . . . 0.0 109.485 -177.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.527 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 7.0 t -147.63 31.1 0.89 Allowed 'General case' 0 C--N 1.357 0.912 0 O-C-N 124.839 1.337 . . . . 0.0 112.573 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.444 ' NZ ' ' O ' ' A' ' 19' ' ' GLY . 0.3 OUTLIER -108.0 127.93 54.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.695 -176.144 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.432 HG21 HG22 ' A' ' 65' ' ' THR . 8.4 p -74.45 132.78 42.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 111.244 -177.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -51.1 -36.98 43.14 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 112.484 -2.144 . . . . 0.0 113.557 -174.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.406 ' O ' ' NZ ' ' A' ' 70' ' ' LYS . 0.2 OUTLIER -125.12 41.57 3.48 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.511 1.148 . . . . 0.0 110.289 -178.464 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.444 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . . . -177.93 -123.52 0.8 Allowed Glycine 0 CA--C 1.542 1.748 0 C-N-CA 115.435 -3.269 . . . . 0.0 115.797 176.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.63 -167.35 1.77 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 112.645 -1.777 . . . . 0.0 112.62 -163.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.0 tp10 -95.99 141.33 29.53 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 168.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 42.2 m -75.96 157.73 32.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 124.315 2.007 . . . . 0.0 112.954 -177.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.31 135.45 33.45 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 109.008 -3.724 . . . . 0.0 106.439 177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.33 143.75 56.56 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.118 -177.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -63.43 -1.17 1.06 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 118.398 2.74 . . . . 0.0 118.398 -171.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -95.95 -135.81 0.23 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 121.985 2.175 . . . . 0.0 109.01 -179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.5 t -118.36 115.96 25.75 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-O 122.685 1.231 . . . . 0.0 109.333 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -144.32 -62.34 0.38 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 111.394 -2.639 . . . . 0.0 109.604 -176.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -176.79 171.84 0.93 Allowed Pre-proline 0 CA--C 1.545 0.756 0 N-CA-C 103.586 -2.746 . . . . 0.0 103.586 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -61.82 -17.76 3.93 Favored 'Cis proline' 0 C--N 1.369 1.617 0 O-C-N 123.761 1.4 . . . . 0.0 115.092 -14.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.62 169.23 8.78 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.13 78.58 2.28 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 124.99 1.431 . . . . 0.0 110.413 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.2 p80 -69.66 176.2 3.7 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 112.73 -2.032 . . . . 0.0 110.638 178.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.66 174.07 55.21 Favored Glycine 0 CA--C 1.536 1.347 0 CA-C-N 114.101 -1.409 . . . . 0.0 110.269 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 58.67 75.33 0.4 Allowed 'General case' 0 CA--C 1.545 0.766 0 O-C-N 124.92 1.012 . . . . 0.0 110.474 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 16.0 mt -120.05 131.33 24.45 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-N 113.316 -1.765 . . . . 0.0 107.722 -177.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 40' ' ' LYS . 9.0 Cg_endo -60.35 -26.34 82.46 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 121.623 1.548 . . . . 0.0 114.383 -171.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 p -74.75 33.13 0.09 Allowed 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.41 ' H ' ' C ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -146.01 1.58 0.87 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.024 1.73 . . . . 0.0 110.532 175.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -123.52 120.18 27.03 Favored Pre-proline 0 C--N 1.35 0.597 0 O-C-N 123.746 0.654 . . . . 0.0 109.577 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.17 -6.37 18.8 Favored 'Trans proline' 0 C--N 1.365 1.418 0 O-C-N 122.833 0.912 . . . . 0.0 112.305 161.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -77.85 168.66 19.58 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 175.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.31 1.43 51.95 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 119.521 -0.872 . . . . 0.0 110.99 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.7 p-10 -39.14 -77.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -176.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.97 129.48 37.96 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 117.555 -1.658 . . . . 0.0 108.908 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' NZ ' ' CG ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -115.32 -131.4 0.32 Allowed 'General case' 0 C--N 1.349 0.576 0 CA-C-N 113.312 -1.767 . . . . 0.0 107.862 -176.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -73.12 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.352 0.688 0 N-CA-C 107.632 -1.248 . . . . 0.0 107.632 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -122.59 -8.99 8.48 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.071 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -46.59 128.52 10.47 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.79 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.543 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 6.2 m -58.91 134.4 56.9 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 113.148 -1.842 . . . . 0.0 112.884 -174.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 9' ' ' TYR . 6.8 mmm180 -126.96 -163.06 1.21 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 113.848 -1.523 . . . . 0.0 107.929 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -149.21 65.37 7.96 Favored Pre-proline 0 CA--C 1.548 0.875 0 CA-C-N 113.872 -1.513 . . . . 0.0 109.827 178.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.74 -42.08 71.95 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 115.857 1.445 . . . . 0.0 115.857 -177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.636 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 9.1 p-10 -96.42 -2.49 45.35 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.321 177.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.405 HH21 ' CD ' ' A' ' 7' ' ' GLU 0.505 0.0 OUTLIER 47.18 68.26 0.67 Allowed 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 112.057 -2.338 . . . . 0.0 114.173 -177.338 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.512 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.8 tp10 -68.75 178.28 2.19 Favored 'General case' 0 CA--C 1.541 0.616 1 CA-C-N 108.329 -4.032 . . . . 0.0 104.946 169.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 62.6 tp -66.47 -89.13 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.051 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 1.6 ttm180 -67.26 137.65 94.07 Favored Pre-proline 0 CA--C 1.551 1.011 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.154 -178.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.403 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 28.1 Cg_endo -59.63 135.52 64.78 Favored 'Trans proline' 0 C--N 1.372 1.767 0 N-CA-C 109.357 -1.055 . . . . 0.0 109.357 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.418 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 62.8 p-90 -126.24 171.1 11.2 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 124.347 1.03 . . . . 0.0 110.494 -176.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.6 p -154.03 165.61 35.62 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 113.132 -1.849 . . . . 0.0 107.201 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 67.6 m-85 -75.87 152.47 37.19 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 113.726 -1.579 . . . . 0.0 107.896 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.432 HG22 HG21 ' A' ' 16' ' ' THR . 0.2 OUTLIER -106.01 173.68 6.21 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 122.275 1.036 . . . . 0.0 109.273 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 27.1 p -77.47 -16.92 58.49 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 113.128 -1.851 . . . . 0.0 111.169 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -83.43 123.28 76.95 Favored Pre-proline 0 CA--C 1.551 0.987 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.875 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_exo -58.77 -4.44 1.96 Allowed 'Trans proline' 0 C--N 1.369 1.625 0 N-CA-C 117.865 2.217 . . . . 0.0 117.865 172.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -107.61 -46.37 3.84 Favored 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 2.9 tppp? -84.54 76.68 10.15 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -75.67 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 114.132 -1.395 . . . . 0.0 111.577 -176.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.44 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 45.3 p-90 -103.01 153.68 20.01 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.376 177.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.401 ' OE2' ' NZ ' ' A' ' 70' ' ' LYS . 66.5 tt0 -157.98 144.01 17.31 Favored 'General case' 0 C--N 1.346 0.438 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.588 173.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.2 mt -68.15 135.45 52.12 Favored 'General case' 0 C--N 1.349 0.584 0 CA-C-N 112.485 -2.143 . . . . 0.0 109.024 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.627 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.0 m -90.81 157.41 17.4 Favored 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.137 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -101.39 103.8 14.75 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-N 114.0 -1.455 . . . . 0.0 107.284 174.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.1 mp -108.44 145.0 30.65 Favored Pre-proline 0 CA--C 1.546 0.814 0 CA-C-N 112.552 -2.113 . . . . 0.0 106.539 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -69.69 126.61 13.56 Favored 'Trans proline' 0 C--N 1.362 1.253 0 C-N-CA 121.826 1.684 . . . . 0.0 112.219 177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -74.22 144.9 44.52 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 113.764 -1.562 . . . . 0.0 107.964 175.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 76.2 m -61.37 110.2 1.37 Allowed 'General case' 0 C--N 1.349 0.545 0 C-N-CA 118.621 -1.232 . . . . 0.0 108.747 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.542 0.655 0 CA-C-N 113.234 -1.803 . . . . 0.0 108.641 -176.349 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.636 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . 0.27 0.8 OUTLIER . . . . . 0 N--CA 1.438 -1.067 0 N-CA-C 102.213 -3.254 . . . . 0.0 102.213 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 3.9 m -162.44 125.51 2.91 Favored 'General case' 0 C--N 1.345 0.386 0 O-C-N 124.387 1.054 . . . . 0.0 109.34 -179.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 55.31 36.47 27.12 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 113.897 -1.501 . . . . 0.0 111.622 177.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -99.01 0.07 43.09 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.171 -1.377 . . . . 0.0 114.462 -174.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 20.6 p -125.22 124.28 41.36 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -128.33 168.94 14.83 Favored 'General case' 0 C--N 1.347 0.476 0 CA-C-N 113.433 -1.712 . . . . 0.0 107.809 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.37 -36.85 77.24 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 112.292 -2.231 . . . . 0.0 110.769 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 174.96 -38.49 0.11 Allowed Glycine 0 C--N 1.354 1.561 0 C-N-CA 116.987 -2.53 . . . . 0.0 114.826 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.8 p -96.39 -46.53 6.35 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -173.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.96 55.06 21.23 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 119.345 -1.407 . . . . 0.0 115.202 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -65.89 -35.81 81.67 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 115.856 -2.338 . . . . 0.0 110.387 176.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -97.84 11.44 37.29 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.57 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -78.91 107.6 11.76 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.138 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -133.29 61.42 1.68 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 106.845 -1.539 . . . . 0.0 106.845 172.713 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -97.99 -110.02 2.86 Favored Glycine 0 C--N 1.354 1.549 0 CA-C-N 113.645 -1.616 . . . . 0.0 112.297 -175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -142.13 -10.91 0.86 Allowed 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 117.183 2.29 . . . . 0.0 117.183 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -81.44 137.03 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 117.995 -1.482 . . . . 0.0 108.722 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' SG ' ' A' ' 51' ' ' CYS . 4.5 t -141.54 22.08 2.17 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 113.476 -1.693 . . . . 0.0 112.829 -179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.411 ' NZ ' ' O ' ' A' ' 18' ' ' SER . 7.8 tmtt? -104.5 125.06 50.33 Favored 'General case' 0 C--N 1.35 0.609 0 C-N-CA 118.879 -1.129 . . . . 0.0 109.025 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.436 ' CG2' ' SG ' ' A' ' 22' ' ' CYS . 18.2 p -72.52 127.89 33.94 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 113.204 -1.816 . . . . 0.0 109.014 -178.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 17.4 ptt? -31.43 -39.97 0.03 OUTLIER 'General case' 0 C--N 1.349 0.58 0 C-N-CA 128.74 2.816 . . . . 0.0 115.083 -169.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.411 ' O ' ' NZ ' ' A' ' 15' ' ' LYS . 7.4 m -119.31 -57.67 1.98 Allowed 'General case' 0 C--N 1.344 0.337 0 C-N-CA 119.249 -0.981 . . . . 0.0 108.854 176.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -54.1 -119.43 0.01 OUTLIER Glycine 0 CA--C 1.548 2.14 0 N-CA-C 117.326 1.69 . . . . 0.0 117.326 -177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 mp -117.72 -173.59 2.46 Favored 'General case' 0 C--N 1.349 0.558 0 CA-C-O 122.304 1.049 . . . . 0.0 113.046 -163.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -80.06 144.81 32.85 Favored 'General case' 0 C--N 1.346 0.451 0 N-CA-C 105.033 -2.21 . . . . 0.0 105.033 172.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.436 ' SG ' ' CG2' ' A' ' 16' ' ' THR . 35.7 m -80.15 154.89 27.73 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 124.297 1.999 . . . . 0.0 112.515 -179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.84 134.89 34.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 109.305 -3.589 . . . . 0.0 106.429 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.44 146.34 29.89 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.851 -1.068 . . . . 0.0 113.385 -176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -67.08 -14.35 62.82 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -173.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -87.91 -144.92 0.13 Allowed 'General case' 0 C--N 1.353 0.737 0 C-N-CA 116.673 -2.011 . . . . 0.0 109.682 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 16.7 t -103.32 113.71 27.42 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.194 -1.41 . . . . 0.0 107.194 179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -143.11 -81.83 0.19 Allowed 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 113.226 -1.806 . . . . 0.0 111.838 -174.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.9 p 169.51 134.54 0.06 OUTLIER Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 106.928 -1.508 . . . . 0.0 106.928 -175.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -78.44 -12.03 33.47 Favored 'Cis proline' 0 C--N 1.365 1.444 0 N-CA-C 119.668 2.911 . . . . 0.0 119.668 19.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.94 158.04 14.43 Favored 'General case' 0 C--N 1.351 0.664 0 C-N-CA 117.002 -1.879 . . . . 0.0 110.796 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.52 69.94 5.89 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 113.021 -1.9 . . . . 0.0 109.942 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -70.54 174.28 6.01 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 113.095 -1.866 . . . . 0.0 110.249 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -75.43 177.63 48.73 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.727 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 65.41 64.65 0.59 Allowed 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 113.49 -1.355 . . . . 0.0 109.782 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.4 mt -104.74 116.18 61.37 Favored Pre-proline 0 CA--C 1.555 1.163 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.201 -174.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -55.57 -27.54 60.45 Favored 'Trans proline' 0 C--N 1.372 1.785 0 N-CA-C 116.204 1.578 . . . . 0.0 116.204 -175.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.3 p -65.68 -5.75 9.41 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 118.219 -1.392 . . . . 0.0 113.113 178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -112.91 7.03 18.14 Favored 'General case' 0 C--N 1.35 0.624 0 O-C-N 123.745 0.653 . . . . 0.0 110.485 -177.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -123.57 118.85 27.29 Favored Pre-proline 0 C--N 1.349 0.582 0 O-C-N 123.847 0.717 . . . . 0.0 110.244 -178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.71 -7.54 20.28 Favored 'Trans proline' 0 C--N 1.367 1.508 0 O-C-N 122.686 0.835 . . . . 0.0 112.142 159.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.75 160.64 30.48 Favored 'General case' 0 C--N 1.352 0.676 0 N-CA-C 106.706 -1.591 . . . . 0.0 106.706 175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' A' ' 10' ' ' ASP . 0.0 OUTLIER -96.56 20.31 10.92 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-O 121.126 0.488 . . . . 0.0 110.35 -179.239 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -59.4 -83.27 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.273 -177.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.95 162.85 15.68 Favored 'General case' 0 C--N 1.347 0.485 0 C-N-CA 118.524 -1.27 . . . . 0.0 110.324 -176.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 -141.33 0.12 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 113.263 -1.79 . . . . 0.0 107.078 -177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -69.21 -90.5 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 O-C-N 124.722 1.264 . . . . 0.0 107.77 176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -122.21 -13.06 8.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.572 0.701 . . . . 0.0 110.727 174.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -45.3 131.43 8.04 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 114.286 -1.324 . . . . 0.0 111.491 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.515 ' SG ' ' HA ' ' A' ' 14' ' ' SER . 5.2 m -59.05 144.53 45.11 Favored 'General case' 0 C--N 1.346 0.443 0 CA-C-N 114.031 -1.44 . . . . 0.0 112.319 -175.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -139.41 -168.51 2.48 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 112.981 -1.918 . . . . 0.0 107.034 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -145.2 65.56 11.87 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 118.608 -1.237 . . . . 0.0 110.368 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -56.69 -29.94 81.95 Favored 'Trans proline' 0 C--N 1.366 1.479 0 N-CA-C 116.703 1.771 . . . . 0.0 116.703 -174.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.668 ' OD2' ' H71' ' A' ' 84' ' ' AMH . 8.4 p-10 -111.06 5.7 20.39 Favored 'General case' 0 CA--C 1.548 0.865 0 CA-C-N 113.759 -1.564 . . . . 0.0 111.202 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.55 0.0 OUTLIER 41.62 65.17 0.89 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 112.779 -2.009 . . . . 0.0 114.912 -174.649 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.54 ' OE2' ' H72' ' A' ' 84' ' ' AMH . 8.5 tp10 -65.32 165.94 10.85 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 109.485 -3.507 . . . . 0.0 106.477 171.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 57.1 tp -52.22 -56.82 12.16 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.037 -0.983 . . . . 0.0 111.731 -177.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.8 ttt180 -105.27 145.08 30.07 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 112.894 -1.957 . . . . 0.0 106.941 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -68.96 138.82 41.38 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 121.655 1.57 . . . . 0.0 108.455 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.413 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 66.6 p-90 -127.71 177.33 6.88 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 124.602 1.189 . . . . 0.0 109.678 -176.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.412 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 1.7 p -159.17 167.03 30.14 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 112.131 -2.304 . . . . 0.0 105.87 173.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -76.32 148.07 37.75 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 114.11 -1.405 . . . . 0.0 108.313 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.35 167.08 11.75 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.581 -1.248 . . . . 0.0 108.988 -178.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.5 p -81.39 -8.79 59.79 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.163 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -79.96 121.9 82.62 Favored Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.42 1.55 2.98 Favored 'Trans proline' 0 C--N 1.365 1.442 0 N-CA-C 114.562 0.947 . . . . 0.0 114.562 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -113.5 -4.22 13.58 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.752 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.6 tptm -127.27 103.86 7.63 Favored 'General case' 0 C--N 1.352 0.699 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -86.32 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.128 -179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.432 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 38.8 p-90 -97.81 164.89 12.2 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 122.165 0.983 . . . . 0.0 111.034 -179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -168.44 142.36 3.21 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 113.359 -1.746 . . . . 0.0 109.654 172.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -69.8 142.22 53.2 Favored 'General case' 0 C--N 1.348 0.534 0 CA-C-N 112.917 -1.947 . . . . 0.0 109.952 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 82.0 m -93.13 154.8 17.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 114.113 -1.403 . . . . 0.0 111.428 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -102.89 117.14 33.95 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 173.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 39.6 mm -113.72 133.6 22.21 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-N 112.823 -1.99 . . . . 0.0 108.342 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.56 108.84 2.74 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 120.562 0.842 . . . . 0.0 111.829 -177.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.5 ptt-85 -73.56 138.89 45.24 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.38 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.9 m -77.29 136.99 38.53 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 176.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p . . . . . 0 CA--C 1.538 0.513 0 O-C-N 124.926 1.391 . . . . 0.0 108.033 -179.569 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.668 ' H71' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . 0.542 ' H2 ' ' CD ' ' A' ' -1' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.449 -0.525 0 N-CA-C 103.828 -2.656 . . . . 0.0 103.828 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -167.52 -40.87 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 109.592 -3.458 . . . . 0.0 112.331 -161.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -144.27 12.73 1.58 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 124.352 1.032 . . . . 0.0 113.223 -173.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . 0.542 ' CD ' ' H2 ' ' A' ' -4' ' ' THR . 55.9 mp0 -79.7 69.85 6.1 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 119.63 -0.828 . . . . 0.0 112.323 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 5.6 p -157.65 132.71 8.76 Favored 'General case' 0 C--O 1.224 -0.257 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 171.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -128.66 177.14 7.25 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.512 -173.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.02 -43.62 19.31 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.559 -2.11 . . . . 0.0 109.574 174.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.98 -64.89 0.06 OUTLIER Glycine 0 CA--C 1.536 1.345 0 CA-C-N 113.526 -1.67 . . . . 0.0 110.763 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -82.23 -34.65 28.76 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-N 114.698 -0.751 . . . . 0.0 110.792 -178.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 65.66 48.45 67.41 Favored Glycine 0 C--N 1.345 1.063 0 C-N-CA 118.564 -1.779 . . . . 0.0 113.995 175.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -58.66 -19.85 43.01 Favored 'General case' 0 CA--C 1.559 1.289 0 CA-C-N 113.38 -1.41 . . . . 0.0 113.058 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -106.14 1.56 26.33 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 115.007 -0.997 . . . . 0.0 111.552 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -68.55 148.76 50.08 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.846 179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -82.36 -58.58 2.87 Favored 'General case' 0 C--N 1.354 0.762 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 117.31 104.84 2.32 Favored Glycine 0 C--N 1.346 1.092 0 O-C-N 124.641 1.213 . . . . 0.0 110.203 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.9 mttp -133.23 -19.18 2.21 Favored 'General case' 0 CA--C 1.555 1.139 0 CA-C-N 112.893 -1.653 . . . . 0.0 111.233 173.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.4 mt -78.14 148.18 6.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.926 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 175.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.5 t -141.31 36.14 1.69 Allowed 'General case' 0 CA--C 1.552 1.041 0 O-C-N 124.431 1.082 . . . . 0.0 112.34 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.469 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 5.9 mmtm -123.38 122.51 38.48 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 119.07 -1.052 . . . . 0.0 110.26 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 14.6 p -84.45 127.29 33.93 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-N 113.302 -1.772 . . . . 0.0 110.044 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -36.91 -41.51 0.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 128.573 2.749 . . . . 0.0 115.268 -175.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -114.79 -52.05 2.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 113.866 -1.515 . . . . 0.0 110.783 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.62 -110.47 0.01 OUTLIER Glycine 0 CA--C 1.546 2.007 0 CA-C-N 111.833 -2.44 . . . . 0.0 116.932 -173.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 20.1 mt -141.61 -163.15 1.51 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 122.247 1.023 . . . . 0.0 109.309 -168.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 33.3 tp10 -78.3 142.36 37.83 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 172.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.4 m -73.57 152.74 40.5 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 123.63 1.681 . . . . 0.0 112.074 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.43 HE22 ' CD2' ' A' ' 33' ' ' HIS . 0.1 OUTLIER -100.13 137.71 38.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 110.311 -3.131 . . . . 0.0 105.691 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.54 151.93 40.04 Favored 'General case' 0 C--O 1.216 -0.668 0 CA-C-N 114.295 -1.32 . . . . 0.0 114.193 -173.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -69.7 -0.15 6.51 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.2 p30 -80.32 -140.51 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.7 t -132.92 122.15 23.89 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.97 -76.19 0.17 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 113.135 -1.848 . . . . 0.0 112.263 -169.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 40.5 t 170.31 148.58 0.14 Allowed Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 102.726 -3.064 . . . . 0.0 102.726 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -68.06 -20.5 9.07 Favored 'Cis proline' 0 C--N 1.368 1.568 0 N-CA-C 118.908 2.618 . . . . 0.0 118.908 9.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -173.75 158.98 3.4 Favored 'General case' 0 C--N 1.348 0.537 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.85 101.94 1.17 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 124.918 1.386 . . . . 0.0 107.637 173.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.43 ' CD2' HE22 ' A' ' 23' ' ' GLN . 14.0 p80 -89.03 -177.51 5.47 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 112.752 -2.022 . . . . 0.0 109.611 -179.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -82.24 178.79 53.4 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.199 177.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 62.5 60.83 1.31 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.645 1.212 . . . . 0.0 108.998 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.1 mt -98.52 120.68 58.66 Favored Pre-proline 0 CA--C 1.545 0.752 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.582 -174.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -47.03 -25.41 4.04 Favored 'Trans proline' 0 C--N 1.368 1.558 0 N-CA-C 118.339 2.399 . . . . 0.0 118.339 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.76 -15.79 54.92 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 -179.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -102.48 -0.37 32.45 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.338 -0.847 . . . . 0.0 110.743 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -123.18 106.43 33.45 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.499 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -71.06 -6.91 20.25 Favored 'Trans proline' 0 C--N 1.365 1.396 0 CA-C-O 121.922 0.718 . . . . 0.0 112.109 165.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -82.92 170.87 14.47 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.785 -1.552 . . . . 0.0 108.09 177.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.405 ' HD3' ' H ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -100.7 17.91 20.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.893 -176.088 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -67.99 -24.6 65.15 Favored 'General case' 0 C--N 1.353 0.73 0 C-N-CA 118.234 -1.386 . . . . 0.0 113.104 -178.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -112.87 133.34 54.9 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 173.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.91 -131.05 0.19 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 113.979 -1.464 . . . . 0.0 107.184 178.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -78.13 -113.92 0.01 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 118.578 -1.249 . . . . 0.0 109.552 176.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p-10 -108.18 20.82 18.19 Favored 'General case' 0 C--O 1.22 -0.481 0 CA-C-O 122.104 0.954 . . . . 0.0 111.56 -177.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -83.97 136.23 34.14 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 113.414 -1.721 . . . . 0.0 112.163 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 18.2 m -55.34 140.04 40.92 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 112.925 -1.943 . . . . 0.0 113.599 -179.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -143.86 -170.04 3.23 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 125.325 1.64 . . . . 0.0 108.693 177.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -132.55 55.03 15.43 Favored Pre-proline 0 C--N 1.355 0.821 0 CA-C-N 113.356 -1.747 . . . . 0.0 112.096 -176.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -52.82 -45.43 40.73 Favored 'Trans proline' 0 C--N 1.366 1.458 0 N-CA-C 114.975 1.106 . . . . 0.0 114.975 -178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.659 ' OD1' ' H4 ' ' A' ' 84' ' ' AMH . 7.6 p-10 -101.79 4.85 40.84 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 113.409 -1.723 . . . . 0.0 111.334 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . 0.252 0.0 OUTLIER 35.38 76.52 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 CA-C-O 124.324 2.011 . . . . 0.0 114.295 179.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.74 -152.49 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 108.428 -3.987 . . . . 0.0 111.448 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 6.8 tt -73.41 -69.72 0.41 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 112.502 -2.136 . . . . 0.0 110.635 176.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 40.7 ttt180 -120.0 136.0 24.69 Favored Pre-proline 0 CA--C 1.555 1.151 0 O-C-N 124.854 1.346 . . . . 0.0 107.496 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.66 142.92 90.89 Favored 'Trans proline' 0 C--N 1.37 1.666 0 C-N-CA 122.989 2.46 . . . . 0.0 111.818 -168.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.408 ' CZ2' ' H61' ' A' ' 84' ' ' AMH . 57.5 p-90 -125.56 175.53 7.48 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 122.697 1.237 . . . . 0.0 112.177 -175.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 75' ' ' CYS . 1.3 p -157.96 165.84 34.12 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 111.777 -2.465 . . . . 0.0 106.556 173.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -73.47 159.47 33.17 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.255 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -110.2 173.21 6.44 Favored 'General case' 0 C--N 1.348 0.525 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 178.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 23.6 p -81.32 -10.54 59.54 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 113.901 -1.5 . . . . 0.0 112.086 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -90.47 128.85 47.29 Favored Pre-proline 0 CA--C 1.549 0.94 0 C-N-CA 119.709 -0.796 . . . . 0.0 110.185 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -59.4 -8.74 7.33 Favored 'Trans proline' 0 C--N 1.368 1.582 0 N-CA-C 118.226 2.356 . . . . 0.0 118.226 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -101.6 -45.88 5.13 Favored 'General case' 0 C--N 1.348 0.535 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -178.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.567 ' HZ2' ' CD ' ' A' ' 73' ' ' GLU . 0.0 OUTLIER -88.46 75.42 8.41 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 178.563 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.623 HH21 ' C8 ' ' A' ' 84' ' ' AMH . 33.0 ttt180 -47.94 -71.54 0.07 Allowed 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.533 -1.667 . . . . 0.0 110.598 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.418 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 58.0 p-90 -107.81 158.99 16.85 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 113.408 -1.724 . . . . 0.0 109.98 178.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.567 ' CD ' ' HZ2' ' A' ' 70' ' ' LYS . 6.4 tp10 -160.43 145.79 14.84 Favored 'General case' 0 C--N 1.346 0.455 0 CA-C-N 114.537 -1.21 . . . . 0.0 108.633 171.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.5 mt -70.19 140.28 52.48 Favored 'General case' 0 C--N 1.348 0.527 0 CA-C-N 113.374 -1.739 . . . . 0.0 110.063 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.549 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 75.9 m -84.25 154.7 22.85 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 113.541 -1.663 . . . . 0.0 111.119 178.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -98.42 98.51 9.71 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 113.399 -1.728 . . . . 0.0 106.401 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.3 mp -97.89 139.37 21.26 Favored Pre-proline 0 CA--C 1.548 0.874 0 CA-C-N 113.03 -1.896 . . . . 0.0 108.422 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -75.39 126.73 9.91 Favored 'Trans proline' 0 C--N 1.364 1.378 0 C-N-CA 123.133 2.555 . . . . 0.0 110.539 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -74.82 150.76 39.16 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 113.493 -1.685 . . . . 0.0 108.562 177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.6 m -72.69 79.86 1.11 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 119.517 -0.873 . . . . 0.0 110.372 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 CA--C 1.541 0.621 0 CA-C-N 114.456 -1.247 . . . . 0.0 109.114 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.659 ' H4 ' ' OD1' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.538 0 CA-C-O 122.38 1.086 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' SER . . . . . 0.442 ' OG ' ' NZ ' ' A' ' 12' ' ' LYS . 5.9 t 75.4 13.36 3.08 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 112.773 -2.012 . . . . 0.0 114.023 176.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.56 135.43 57.75 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 125.314 1.634 . . . . 0.0 107.595 174.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.9 -53.42 3.06 Favored 'General case' 0 C--N 1.346 0.445 0 O-C-N 124.571 1.17 . . . . 0.0 112.918 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 1.3 p -103.93 133.22 49.27 Favored 'General case' 0 C--N 1.352 0.693 0 CA-C-O 121.835 0.826 . . . . 0.0 110.713 -178.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.63 159.09 42.87 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 113.202 -1.817 . . . . 0.0 106.571 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.4 m-70 -56.13 -48.74 75.65 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 112.901 -1.954 . . . . 0.0 108.207 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.94 17.84 0.02 OUTLIER Glycine 0 CA--C 1.536 1.362 0 CA-C-N 112.72 -2.036 . . . . 0.0 113.77 174.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.6 p -94.81 -66.12 0.94 Allowed 'General case' 0 C--N 1.348 0.523 0 CA-C-O 121.337 0.589 . . . . 0.0 110.392 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 72.48 38.26 57.99 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 113.798 -1.546 . . . . 0.0 113.818 177.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -43.49 -46.93 7.08 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.271 -0.964 . . . . 0.0 112.783 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -124.85 26.49 7.07 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 114.421 -1.263 . . . . 0.0 110.581 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -62.14 129.6 41.58 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.174 -1.376 . . . . 0.0 113.037 -177.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . 0.342 1.8 p30 -150.11 44.55 0.89 Allowed 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 123.974 1.845 . . . . 0.0 110.61 171.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.64 28.28 2.12 Favored Glycine 0 CA--C 1.544 1.852 0 CA-C-N 112.233 -2.258 . . . . 0.0 115.242 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.442 ' NZ ' ' OG ' ' A' ' -3' ' ' SER . 27.7 mmtm 73.92 -19.05 0.37 Allowed 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 mp -66.53 129.05 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 C-N-CA 119.158 -1.017 . . . . 0.0 108.29 178.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -134.09 48.28 2.35 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-N 111.621 -2.536 . . . . 0.0 108.896 -178.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.414 ' NZ ' ' OE1' ' A' ' 21' ' ' GLU . 1.3 mptp? -129.46 121.31 27.03 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 75' ' ' CYS . 16.4 p -76.53 130.71 38.31 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 113.722 -1.581 . . . . 0.0 108.689 -178.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -45.53 -33.02 2.51 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 112.107 -2.315 . . . . 0.0 113.97 -172.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 p -127.37 28.2 5.74 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.176 -1.375 . . . . 0.0 111.695 -176.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.9 -95.37 0.1 Allowed Glycine 0 C--N 1.355 1.631 1 C-N-CA 113.87 -4.014 . . . . 0.0 117.413 -176.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.6 mt -135.01 179.58 6.23 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-O 122.831 1.3 . . . . 0.0 112.947 -162.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' NZ ' ' A' ' 15' ' ' LYS . 25.0 tp10 -74.12 140.07 44.99 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 112.105 -2.316 . . . . 0.0 107.878 174.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 21.1 m -76.39 148.48 37.33 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 124.211 1.958 . . . . 0.0 112.38 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -94.37 139.37 31.18 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 109.455 -3.52 . . . . 0.0 106.886 178.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.23 140.18 58.85 Favored 'General case' 0 C--N 1.351 0.658 0 CA-C-N 114.1 -1.409 . . . . 0.0 112.432 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -59.89 -24.16 64.05 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 116.799 2.148 . . . . 0.0 116.799 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -82.69 -152.3 0.11 Allowed 'General case' 0 C--N 1.354 0.79 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.084 -175.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.2 t -96.71 104.75 16.77 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-O 121.729 0.775 . . . . 0.0 108.964 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.21 -55.19 0.48 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 113.207 -1.815 . . . . 0.0 112.045 -178.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.5 p 178.36 176.95 0.3 Allowed Pre-proline 0 CA--C 1.543 0.698 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 -173.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.23 -16.27 2.78 Favored 'Cis proline' 0 C--N 1.365 1.441 0 O-C-N 123.143 1.075 . . . . 0.0 114.614 -22.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -167.81 164.39 14.16 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 104.573 -2.38 . . . . 0.0 104.573 178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.49 93.88 0.71 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 122.728 1.251 . . . . 0.0 109.052 176.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -77.43 -5.78 51.07 Favored 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 111.812 -2.449 . . . . 0.0 113.997 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 90.11 179.7 44.16 Favored Glycine 0 C--N 1.346 1.1 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 58.55 45.16 16.72 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 122.152 0.977 . . . . 0.0 109.899 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.471 HG22 ' NZ ' ' A' ' 40' ' ' LYS . 74.5 mt -99.73 106.2 38.95 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 112.948 -1.933 . . . . 0.0 108.062 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -46.73 -16.27 0.26 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 N-CA-C 120.625 3.279 . . . . 0.0 120.625 -171.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.492 ' OG ' ' NZ ' ' A' ' 40' ' ' LYS . 92.5 p -58.74 -14.49 8.74 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.492 ' NZ ' ' OG ' ' A' ' 39' ' ' SER . 17.6 mtmm -113.01 7.06 17.97 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.114 -178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -114.57 107.79 50.44 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.024 -175.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.45 -10.08 27.87 Favored 'Trans proline' 0 C--N 1.368 1.559 0 CA-C-O 122.219 0.841 . . . . 0.0 112.037 165.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.403 ' O ' ' NZ ' ' A' ' 44' ' ' LYS . 10.4 t-20 -69.16 -167.43 0.11 Allowed 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 113.567 -1.651 . . . . 0.0 107.652 175.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.403 ' NZ ' ' O ' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -144.64 38.35 1.23 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 123.237 1.494 . . . . 0.0 107.867 176.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.403 ' O ' ' NE ' ' A' ' 52' ' ' ARG . 19.1 p-10 -73.6 -53.55 10.23 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 110.625 -2.988 . . . . 0.0 109.325 178.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.95 161.15 21.9 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 117.111 -1.836 . . . . 0.0 108.021 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -142.01 -143.13 0.15 Allowed 'General case' 0 C--N 1.347 0.466 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.108 -177.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -67.53 -94.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.82 0 O-C-N 124.651 1.219 . . . . 0.0 108.871 176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.7 p-10 -133.59 14.42 4.06 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.249 177.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -75.32 148.09 39.6 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.98 -177.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 63' ' ' CYS . 3.2 m -62.2 149.67 40.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 119.027 -1.069 . . . . 0.0 109.959 179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.403 ' NE ' ' O ' ' A' ' 45' ' ' ASN . 25.4 mmm180 -143.55 -176.97 5.17 Favored 'General case' 0 C--N 1.345 0.408 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -179.142 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.42 ' HB3' ' HA ' ' A' ' 56' ' ' ARG . 4.6 m120 -132.54 61.63 58.09 Favored Pre-proline 0 C--N 1.348 0.521 0 CA-C-N 112.44 -2.164 . . . . 0.0 108.628 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -57.53 -32.58 94.66 Favored 'Trans proline' 0 C--N 1.368 1.604 0 CA-C-O 123.353 1.314 . . . . 0.0 114.088 -176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.774 ' OD2' ' H4 ' ' A' ' 84' ' ' AMH . 31.6 p30 -114.06 -0.44 14.03 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 110.168 -3.197 . . . . 0.0 112.434 -177.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.42 ' HA ' ' HB3' ' A' ' 53' ' ' ASN 0.487 0.0 OUTLIER 42.55 64.4 1.16 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.855 1.788 . . . . 0.0 115.063 -171.177 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.495 ' OE2' ' C7 ' ' A' ' 84' ' ' AMH . 3.9 tp10 -61.41 165.63 4.58 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 109.393 -3.549 . . . . 0.0 107.215 170.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 49.8 tp -54.64 -47.09 73.93 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 114.262 -1.335 . . . . 0.0 111.813 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' HG3' ' HD2' ' A' ' 61' ' ' PRO . 0.0 OUTLIER -114.65 145.13 33.23 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 113.023 -1.898 . . . . 0.0 107.744 179.112 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.401 ' HD2' ' HG3' ' A' ' 59' ' ' ARG . 29.7 Cg_endo -64.52 131.4 29.6 Favored 'Trans proline' 0 C--N 1.367 1.517 0 C-N-CA 120.783 0.989 . . . . 0.0 109.619 175.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 66.6 p-90 -127.79 169.07 14.29 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-O 122.195 0.998 . . . . 0.0 111.784 -176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.487 ' SG ' ' SG ' ' A' ' 51' ' ' CYS . 0.8 OUTLIER -155.76 169.05 25.27 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 112.615 -2.084 . . . . 0.0 105.9 174.075 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -76.15 149.71 37.29 Favored 'General case' 0 C--N 1.345 0.387 0 CA-C-N 114.008 -1.451 . . . . 0.0 107.896 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.08 176.0 6.49 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 118.744 -1.183 . . . . 0.0 108.193 -179.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -87.98 -6.17 58.14 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 113.544 -1.662 . . . . 0.0 111.74 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -84.89 131.35 49.35 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.051 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.55 -5.63 0.78 Allowed 'Trans proline' 0 C--N 1.368 1.555 0 N-CA-C 119.675 2.913 . . . . 0.0 119.675 174.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -119.98 -36.42 3.28 Favored 'General case' 0 C--N 1.347 0.457 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.19 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 3.0 tptm -84.87 88.89 7.45 Favored 'General case' 0 C--N 1.348 0.537 0 C-N-CA 117.965 -1.494 . . . . 0.0 107.614 178.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 2.5 tmm_? -60.07 -83.87 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 113.221 -1.808 . . . . 0.0 111.823 -178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' CG ' ' H62' ' A' ' 84' ' ' AMH . 53.5 p-90 -92.88 159.29 15.42 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.658 0.742 . . . . 0.0 111.088 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -166.45 144.66 5.4 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.547 171.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.3 mt -70.57 145.24 50.9 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 111.905 -2.407 . . . . 0.0 109.732 178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 79.2 m -105.8 161.55 14.32 Favored 'General case' 0 C--O 1.22 -0.462 0 O-C-N 124.634 1.209 . . . . 0.0 110.641 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -110.89 122.5 48.03 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 169.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.2 mp -110.81 141.4 24.03 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 104.107 -2.553 . . . . 0.0 104.107 -178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -40.69 126.47 2.31 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 122.662 2.241 . . . . 0.0 116.93 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.9 123.09 25.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 113.263 -1.789 . . . . 0.0 108.236 177.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 83.5 m -70.3 85.16 0.57 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.54 178.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.545 0.767 0 CA-C-N 114.468 -1.242 . . . . 0.0 108.286 179.556 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' AMH . . . . . 0.774 ' H4 ' ' OD2' ' A' ' 55' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_