data_2kvs_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 2kvs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 CA-C-O 120.812 0.255 . . . . 73.310000000000002 112.29 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 75.019999999999996 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 63.109999999999999 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.140000000000001 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.402 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 62.140000000000001 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.239999999999995 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 72.25 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.411 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.230000000000004 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.140000000000001 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.409999999999997 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.510000000000005 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . 3.9 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 71.049999999999997 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.400000000000006 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.030000000000001 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.329999999999998 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.219999999999999 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.120000000000005 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 75.239999999999995 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.119999999999997 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 70.430000000000007 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.430000000000007 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 62.399999999999999 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.439999999999998 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.486 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 2.9 t60 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.150000000000006 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 73.230000000000004 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.140000000000001 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.209999999999994 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.310000000000002 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.549999999999997 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.310000000000002 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.209999999999994 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.030000000000001 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.319999999999993 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.030000000000001 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.150000000000006 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.510000000000005 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.109999999999999 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.430000000000007 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 63.049999999999997 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.129999999999995 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 73.439999999999998 110.851 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 64.109999999999999 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.758 HG21 HG22 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.329999999999998 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.679 ' HG2' HG21 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.400000000000006 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.240000000000002 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.530000000000001 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.409999999999997 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.109999999999999 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 75.439999999999998 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.210000000000001 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.549999999999997 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.409999999999997 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.679 HG21 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.010000000000005 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.552 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.439999999999998 111.823 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.109999999999999 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.758 HG22 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.430000000000007 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.552 HD22 ' HA ' ' A' ' 60' ' ' GLU . 11.0 p30 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.010000000000005 111.455 -176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.43 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.530000000000001 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.549999999999997 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.409999999999997 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.420000000000002 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.340000000000003 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.735 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.140000000000001 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.340000000000003 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.319999999999993 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.140000000000001 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.409999999999997 112.39 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 73.530000000000001 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 74.519999999999996 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 . . . . . 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 74.129999999999995 109.866 174.38 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 N-CA-C 113.701 0.616 . . . . 55.340000000000003 113.701 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.140000000000001 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.519999999999996 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 74.299999999999997 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.430000000000007 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.310000000000002 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.140000000000001 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.030000000000001 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.329999999999998 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.540000000000006 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.120000000000005 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.130000000000003 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.120000000000005 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 75.200000000000003 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.150000000000006 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.239999999999995 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.340000000000003 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.219999999999999 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.530000000000001 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.531 HD11 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.109999999999999 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.548 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.130000000000003 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.200000000000003 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.329999999999998 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.030000000000001 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.010000000000005 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.230000000000004 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.230000000000004 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.120000000000005 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.439999999999998 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 70.230000000000004 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.349999999999994 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 70.120000000000005 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.109999999999999 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.129999999999995 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.340000000000003 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.530000000000001 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.450000000000003 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.009999999999998 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.010000000000005 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 72.010000000000005 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 72.109999999999999 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.450000000000003 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.200000000000003 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 75.099999999999994 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.310000000000002 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.010000000000005 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.431 HD21 ' N ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.209999999999994 112.106 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 74.140000000000001 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.049999999999997 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.319999999999993 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.409999999999997 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.409999999999997 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.120000000000005 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.239999999999995 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.310000000000002 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.129999999999995 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.120000000000005 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.120000000000005 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.299999999999997 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.414 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.450000000000003 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.310000000000002 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.019999999999996 111.267 175.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.510000000000005 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.209999999999994 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.409999999999997 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.030000000000001 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.549999999999997 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.25 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.109999999999999 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.540000000000006 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 63.350000000000001 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 74.450000000000003 113.305 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.697 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo . . . . . 0 CA--C 1.542 0.915 0 CA-C-O 121.023 0.343 . . . . 63.229999999999997 112.217 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.439999999999998 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.420000000000002 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.219999999999999 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.340000000000003 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 74.420000000000002 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.129999999999995 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.040000000000006 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.530000000000001 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.109999999999999 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.42 ' OE1' ' HB1' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.519999999999996 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.140000000000001 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.530000000000001 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.450000000000003 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.099999999999994 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.439999999999998 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.230000000000004 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.120000000000005 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.329999999999998 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.209999999999994 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.42 ' HB1' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.030000000000001 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.409999999999997 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.329999999999998 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.030000000000001 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.400000000000006 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.310000000000002 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.439999999999998 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.209999999999994 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 74.349999999999994 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.430000000000007 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.491 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.421 HD21 ' O ' ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.519999999999996 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.540000000000006 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.697 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.319999999999993 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.577 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.230000000000004 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.109999999999999 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.329999999999998 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.420000000000002 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.319999999999993 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 62.219999999999999 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.310000000000002 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.239999999999995 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.543 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 74.120000000000005 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.420000000000002 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.399999999999999 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.010000000000005 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.543 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.239999999999995 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.310000000000002 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.200000000000003 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.420000000000002 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.239999999999995 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 74.239999999999995 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.439999999999998 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.340000000000003 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.439999999999998 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.455 ' OG1' HG12 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.409999999999997 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.449 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.140000000000001 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.43 ' O ' HD21 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.430000000000007 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.219999999999999 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.150000000000006 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.400000000000006 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.43 HD21 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.310000000000002 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.150000000000006 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.450000000000003 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.340000000000003 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.997 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.430000000000007 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.439999999999998 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.140000000000001 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.209999999999994 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 . . . . . 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.450000000000003 110.901 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.588 ' HD2' HG21 ' A' ' 7' ' ' THR . 4.6 Cg_exo . . . . . 0 CA--C 1.547 1.141 0 N-CA-C 112.801 0.269 . . . . 75.450000000000003 112.801 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.439999999999998 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.588 HG21 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.530000000000001 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.510000000000005 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 74.340000000000003 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.619 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.350000000000001 111.767 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.558 ' HB2' ' HH ' ' A' ' 69' ' ' TYR . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.219999999999999 112.124 -177.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.602 HG13 ' HB3' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.019999999999996 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.619 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.109999999999999 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.140000000000001 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.484 HE21 ' HB2' ' A' ' 26' ' ' ALA . 8.3 tp-100 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.010000000000005 111.438 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.209999999999994 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.439999999999998 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.400000000000006 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.465 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.510000000000005 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.140000000000001 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.329999999999998 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.420000000000002 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.240000000000002 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.329999999999998 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.602 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.540000000000006 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.129999999999995 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.530000000000001 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.120000000000005 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.319999999999993 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.230000000000004 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.040000000000006 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.340000000000003 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.414 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.420000000000002 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.119999999999997 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 72.400000000000006 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.439999999999998 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.099999999999994 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.349999999999994 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.661 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.430000000000007 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 75.510000000000005 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.230000000000004 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.557 HG21 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 74.340000000000003 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 74.030000000000001 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.120000000000005 111.509 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.525 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.049999999999997 112.015 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.430000000000007 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.428 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.239999999999995 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.525 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.109999999999999 111.915 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 74.349999999999994 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.230000000000004 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.140000000000001 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.340000000000003 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.239999999999995 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.200000000000003 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.439999999999998 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.299999999999997 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.428 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.420000000000002 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.299999999999997 112.657 -171.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 75.439999999999998 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.209999999999994 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.329999999999998 111.38 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.140000000000001 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.120000000000005 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 75.120000000000005 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.120000000000005 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.420000000000002 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.558 ' HH ' ' HB2' ' A' ' 11' ' ' PHE . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 73.530000000000001 111.935 179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.099999999999994 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.129999999999995 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.120000000000005 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.120000000000005 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.219999999999999 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.319999999999993 111.693 -177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.420000000000002 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.129999999999995 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.6 t60 . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.340000000000003 110.224 179.077 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo . . . . . 0 CA--C 1.539 0.747 0 N-CA-C 112.542 0.17 . . . . 51.450000000000003 112.542 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.329999999999998 112.685 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.140000000000001 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.329999999999998 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.593 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 65.109999999999999 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.658 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 2.6 t-20 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.209999999999994 111.489 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.030000000000001 111.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.503 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.658 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.340000000000003 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.310000000000002 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 74.420000000000002 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.209999999999994 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 70.120000000000005 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 75.329999999999998 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.510000000000005 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 74.140000000000001 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 71.040000000000006 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 73.439999999999998 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.109999999999999 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.150000000000006 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.230000000000004 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.430000000000007 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.409999999999997 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.329999999999998 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 61.32 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.420000000000002 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.040000000000006 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.545 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.200000000000003 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.399999999999999 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.540000000000006 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.509999999999998 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.200000000000003 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.209999999999994 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.129999999999995 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.140000000000001 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.540000000000006 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.58 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 73.430000000000007 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.420000000000002 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.299999999999997 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.549999999999997 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.420000000000002 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.310000000000002 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.340000000000003 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.530000000000001 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 42.409999999999997 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.299999999999997 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.428 HD21 ' N ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.310000000000002 113.168 -176.516 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 75.109999999999999 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.109999999999999 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.444 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 73.540000000000006 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.340000000000003 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 71.299999999999997 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.040000000000006 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.349999999999994 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 75.030000000000001 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 75.400000000000006 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.4 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.409999999999997 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 72.200000000000003 112.227 -173.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 74.349999999999994 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.540000000000006 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.58 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.530000000000001 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.510000000000005 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.209999999999994 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.409999999999997 111.77 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.230000000000004 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.149999999999999 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 75.049999999999997 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 75.230000000000004 110.939 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.430000000000007 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 75.230000000000004 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 72.129999999999995 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.209999999999994 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.439999999999998 110.978 175.996 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.542 0.904 0 CA-C-O 120.961 0.317 . . . . 71.510000000000005 111.67 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.140000000000001 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.030000000000001 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.319999999999993 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.54 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.310000000000002 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.219999999999999 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.209999999999994 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 22' ' ' PHE . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.140000000000001 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.409999999999997 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.119999999999997 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 74.230000000000004 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.310000000000002 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.129999999999995 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.319999999999993 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.019999999999996 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.140000000000001 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.209999999999994 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.454 ' HB3' HD12 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 74.450000000000003 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.200000000000003 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.109999999999999 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 71.209999999999994 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.438 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.340000000000003 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.239999999999995 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 72.439999999999998 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.400000000000006 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 36.810000000000002 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.329999999999998 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 74.129999999999995 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.030000000000001 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.450000000000003 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.420000000000002 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.129999999999995 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.399999999999999 112.641 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 71.340000000000003 111.743 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 73.219999999999999 113.159 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.040000000000006 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.310000000000002 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.439999999999998 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.447 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.109999999999999 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 62.25 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.009999999999998 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.109999999999999 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.329999999999998 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 74.129999999999995 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.400000000000006 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.120000000000005 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.349999999999994 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.120000000000005 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 74.040000000000006 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.399999999999999 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.540000000000006 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 73.099999999999994 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.010000000000005 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.554 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.510000000000005 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.120000000000005 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 75.319999999999993 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.420000000000002 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.030000000000001 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.319999999999993 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.510000000000005 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.329999999999998 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 64.219999999999999 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 60.450000000000003 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 72.230000000000004 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.340000000000003 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.040000000000006 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.530000000000001 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.319999999999993 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.510000000000005 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 74.439999999999998 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.439999999999998 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.430000000000007 110.737 175.022 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 CA--C 1.542 0.924 0 N-CA-C 113.261 0.447 . . . . 75.329999999999998 113.261 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.049999999999997 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 71.299999999999997 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 75.319999999999993 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 71.010000000000005 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.140000000000001 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.120000000000005 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.404 HG12 HD12 ' A' ' 25' ' ' LEU . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.539999999999999 112.381 -174.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 72.340000000000003 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.310000000000002 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.230000000000004 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.635 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.340000000000003 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.329999999999998 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.230000000000004 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.230000000000004 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.109999999999999 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.340000000000003 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 74.109999999999999 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.130000000000003 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 75.239999999999995 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.404 HD12 HG12 ' A' ' 12' ' ' ILE . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.409999999999997 110.288 176.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.430000000000007 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.635 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.349999999999994 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.450000000000003 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.120000000000005 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.120000000000005 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.120000000000005 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.109999999999999 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.340000000000003 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.420000000000002 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.530000000000001 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.109999999999999 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.519999999999996 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.340000000000003 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.519999999999996 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.450000000000003 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.219999999999999 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.140000000000001 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.010000000000005 112.421 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.319999999999993 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.319999999999993 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HB2' HG22 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.310000000000002 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.609 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.129999999999995 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.420000000000002 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 64.510000000000005 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.609 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.510000000000005 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.219999999999999 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.009999999999998 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.413 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.439999999999998 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.040000000000006 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 60.420000000000002 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 75.129999999999995 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.420000000000002 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.329999999999998 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.209999999999994 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.019999999999996 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.439999999999998 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.597 HG21 HG13 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.450000000000003 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.200000000000003 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.329999999999998 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.42 HG22 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.230000000000004 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.239999999999995 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.209999999999994 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.430000000000007 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.129999999999995 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.44 ' HA ' ' HD1' ' A' ' 75' ' ' HIS . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.319999999999993 110.498 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 73.040000000000006 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.400000000000006 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.44 ' HD1' ' HA ' ' A' ' 72' ' ' ASN . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 75.430000000000007 111.658 177.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.239999999999995 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 75.299999999999997 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.240000000000002 109.205 170.89 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 CA--C 1.546 1.12 0 N-CA-C 113.855 0.675 . . . . 74.219999999999999 113.855 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.644 ' HA ' ' HE2' ' A' ' 6' ' ' MET . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.420000000000002 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.430000000000007 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.340000000000003 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.484 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.200000000000003 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.230000000000004 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.299999999999997 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 74.510000000000005 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.109999999999999 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.130000000000003 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.129999999999995 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HB2' ' HB1' ' A' ' 26' ' ' ALA . 0.0 OUTLIER -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.519999999999996 111.575 -177.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 70.200000000000003 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.420000000000002 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.557 HD21 ' N ' ' A' ' 19' ' ' ASN . 0.8 OUTLIER -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.549999999999997 113.587 -164.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 53.329999999999998 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.229999999999997 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 73.25 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 38.159999999999997 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.239999999999995 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.450000000000003 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.473 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.430000000000007 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 73.150000000000006 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.240000000000002 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.603 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.040000000000006 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.019999999999996 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.140000000000001 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.230000000000004 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.329999999999998 111.094 173.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.540000000000006 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.439999999999998 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 73.150000000000006 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.579 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 75.519999999999996 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.416 HD12 ' N ' ' A' ' 38' ' ' LEU . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.030000000000001 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 74.409999999999997 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.120000000000005 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.310000000000002 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.642 ' HB3' HD13 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.219999999999999 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.310000000000002 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.099999999999994 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.439999999999998 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.329999999999998 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.209999999999994 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.319999999999993 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.526 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.409999999999997 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.45 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.319999999999993 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 72.099999999999994 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 75.519999999999996 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.526 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.530000000000001 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.44 HG21 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.150000000000006 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.44 ' H ' HG21 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.209999999999994 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.439999999999998 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.439999999999998 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.549999999999997 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.45 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 73.530000000000001 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.030000000000001 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.310000000000002 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 75.439999999999998 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 71.510000000000005 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.450000000000003 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.010000000000005 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.642 HD13 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.409999999999997 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 74.109999999999999 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.319999999999993 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 71.109999999999999 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.608 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.119999999999997 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.310000000000002 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.329999999999998 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.530000000000001 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 64.230000000000004 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.109999999999999 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 75.040000000000006 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 . . . . . 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.200000000000003 112.476 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 CA--C 1.547 1.156 0 N-CA-C 113.847 0.672 . . . . 62.5 113.847 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.209999999999994 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.450000000000003 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.319999999999993 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 74.540000000000006 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.420000000000002 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.230000000000004 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.299999999999997 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.409999999999997 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.239999999999995 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.430000000000007 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.540000000000006 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.149999999999999 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.450000000000003 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.519999999999996 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.319999999999993 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.120000000000005 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.519999999999996 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.329999999999998 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.120000000000005 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.200000000000003 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.400000000000006 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.109999999999999 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.530000000000001 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.430000000000007 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 74.530000000000001 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.469 ' HB3' ' HZ1' ' A' ' 33' ' ' LYS . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.25 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.439999999999998 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.441 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.420000000000002 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.040000000000006 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.430000000000007 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.542 ' O ' HG23 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.140000000000001 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.099999999999994 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.340000000000003 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.439999999999998 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.445 HD11 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.310000000000002 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.329999999999998 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.340000000000003 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.426 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.450000000000003 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.568 HG12 HG22 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.439999999999998 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.040000000000006 110.974 174.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.140000000000001 111.87 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 51.109999999999999 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.019999999999996 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.129999999999995 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.200000000000003 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.439999999999998 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.129999999999995 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.120000000000005 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.439999999999998 112.313 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.400000000000006 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.420000000000002 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.568 HG22 HG12 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 64.099999999999994 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.200000000000003 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 74.129999999999995 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.510000000000005 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.340000000000003 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.109999999999999 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.340000000000003 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.400000000000006 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.319999999999993 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.140000000000001 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.019999999999996 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.030000000000001 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.040000000000006 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.219999999999999 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 70.5 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.150000000000006 112.406 178.411 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo . . . . . 0 CA--C 1.539 0.763 0 N-CA-C 113.199 0.423 . . . . 74.140000000000001 113.199 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.613 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.239999999999995 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.525 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 71.120000000000005 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.613 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.030000000000001 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.420000000000002 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.678 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.439999999999998 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.240000000000002 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.140000000000001 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.120000000000005 111.207 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.400000000000006 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.409999999999997 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.119999999999997 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 73.299999999999997 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.310000000000002 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.540000000000006 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.020000000000003 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.329999999999998 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.240000000000002 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.678 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.299999999999997 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.099999999999994 111.529 -177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.340000000000003 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.230000000000004 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.240000000000002 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.150000000000006 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.349999999999994 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.019999999999996 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.310000000000002 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.430000000000007 112.578 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.400000000000006 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.109999999999999 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.340000000000003 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.129999999999995 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.129999999999995 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.230000000000004 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.340000000000003 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.540000000000006 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.340000000000003 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.219999999999999 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.530000000000001 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.420000000000002 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.209999999999994 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.109999999999999 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.019999999999996 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 70.150000000000006 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.409999999999997 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.209999999999994 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.409999999999997 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.299999999999997 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 74.310000000000002 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.109999999999999 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.140000000000001 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.519999999999996 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.140000000000001 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.510000000000005 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 70.349999999999994 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 74.109999999999999 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.299999999999997 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.525 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 74.239999999999995 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 64.239999999999995 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 38.82 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.010000000000005 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.040000000000006 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.349999999999994 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 75.030000000000001 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.209999999999994 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.549999999999997 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.549999999999997 111.701 179.152 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 CA-C-O 120.97 0.321 . . . . 61.439999999999998 112.702 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.439999999999998 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.349999999999994 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 74.230000000000004 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.404 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.229999999999997 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 75.409999999999997 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.404 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.510000000000005 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.200000000000003 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 73.310000000000002 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.420000000000002 111.519 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.130000000000003 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.409999999999997 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.349999999999994 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 36.780000000000001 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.539 ' HD1' HG22 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 73.439999999999998 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 36.780000000000001 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.420000000000002 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 72.549999999999997 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 74.349999999999994 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 71.450000000000003 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.431 HG13 ' HH ' ' A' ' 53' ' ' TYR . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 71.230000000000004 111.131 176.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.319999999999993 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.420000000000002 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.420000000000002 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.430000000000007 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.209999999999994 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.049999999999997 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.030000000000001 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.310000000000002 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.73 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.349999999999994 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.519999999999996 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.544 ' O ' HG21 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.340000000000003 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.534 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 74.010000000000005 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.329999999999998 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 64.329999999999998 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.73 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.140000000000001 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.120000000000005 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.510000000000005 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.420000000000002 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.631 HG23 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.329999999999998 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.64 ' HG2' HG21 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.430000000000007 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.340000000000003 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.040000000000006 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.431 ' HH ' HG13 ' A' ' 29' ' ' VAL . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.519999999999996 112.164 -174.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.319999999999993 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.430000000000007 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.140000000000001 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.219999999999999 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.099999999999994 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.64 HG21 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.039999999999999 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.530000000000001 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.539 HG22 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 74.450000000000003 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.631 HG21 HG23 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.430000000000007 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.406 ' ND2' HG22 ' A' ' 59' ' ' ILE . 94.3 m-20 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 72.219999999999999 112.025 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.540000000000006 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.349999999999994 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.473 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.439999999999998 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 75.239999999999995 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.420000000000002 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.534 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.310000000000002 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.019999999999996 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.219999999999999 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.240000000000002 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.349999999999994 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.020000000000003 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.540000000000006 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.439999999999998 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.129999999999995 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.439999999999998 110.759 172.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.543 0.944 0 N-CA-C 113.174 0.413 . . . . 73.129999999999995 113.174 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.310000000000002 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.530000000000001 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.421 ' HZ ' HD13 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.109999999999999 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.538 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 71.230000000000004 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.631 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.340000000000003 111.662 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 73.200000000000003 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.648 HG12 HD12 ' A' ' 25' ' ' LEU . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.409999999999997 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.040000000000006 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.140000000000001 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.219999999999999 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.239999999999995 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.129999999999995 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.229999999999997 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 75.340000000000003 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.409999999999997 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.519999999999996 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.109999999999999 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.049999999999997 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.648 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.420000000000002 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.635 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.030000000000001 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.450000000000003 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 73.409999999999997 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.409999999999997 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.400000000000006 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.219999999999999 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.129999999999995 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.120000000000005 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 74.120000000000005 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.340000000000003 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.450000000000003 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.200000000000003 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.626 ' HA ' HD13 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.409999999999997 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.420000000000002 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.229999999999997 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.310000000000002 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.400000000000006 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.626 HD13 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.439999999999998 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.020000000000003 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.340000000000003 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 72.25 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 70.519999999999996 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 36.5 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.129999999999995 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 51.130000000000003 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 71.010000000000005 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.319999999999993 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.456 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.129999999999995 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.530000000000001 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.010000000000005 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.130000000000003 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.219999999999999 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.540000000000006 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.549999999999997 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.039999999999999 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.219999999999999 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.140000000000001 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.439999999999998 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.140000000000001 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.210000000000001 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.340000000000003 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.450000000000003 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.120000000000005 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.478 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.409999999999997 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.130000000000003 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.109999999999999 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 75.519999999999996 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.239999999999995 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.299999999999997 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 72.030000000000001 111.257 175.226 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo . . . . . 0 CA--C 1.547 1.157 0 N-CA-C 114.67 0.988 . . . . 41.409999999999997 114.67 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 75.230000000000004 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 74.099999999999994 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.319999999999993 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.150000000000006 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.469 ' HB2' ' HH ' ' A' ' 69' ' ' TYR . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.510000000000005 111.454 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.400000000000006 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.140000000000001 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.420000000000002 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.409999999999997 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.439999999999998 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.519999999999996 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.010000000000005 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.310000000000002 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.519999999999996 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.230000000000004 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.498 ' HB3' HD13 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.140000000000001 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.349999999999994 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.439999999999998 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.430000000000007 111.889 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.540000000000006 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.430000000000007 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.518 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.340000000000003 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.319999999999993 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.450000000000003 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.450000000000003 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HB3' ' HZ2' ' A' ' 33' ' ' LYS . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 71.450000000000003 110.249 172.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.109999999999999 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.416 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 74.019999999999996 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.239999999999995 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.416 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.100000000000001 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' N ' HD23 ' A' ' 38' ' ' LEU . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.400000000000006 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.530000000000001 111.939 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.409999999999997 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.510000000000005 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.563 ' HB3' HG21 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.019999999999996 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.219999999999999 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.219999999999999 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.329999999999998 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.439999999999998 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.200000000000003 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.319999999999993 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.475 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.120000000000005 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.519999999999996 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.099999999999994 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.329999999999998 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.549999999999997 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.119999999999997 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.540000000000006 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 71.319999999999993 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.109999999999999 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.426 HG22 ' OD1' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.439999999999998 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HA ' HD22 ' A' ' 63' ' ' ASN . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.230000000000004 112.182 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.540000000000006 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.409999999999997 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.614 HD21 ' N ' ' A' ' 64' ' ' ARG . 0.3 OUTLIER -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.319999999999993 112.729 -173.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.614 ' N ' HD21 ' A' ' 63' ' ' ASN . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.109999999999999 110.724 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.030000000000001 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.563 HG21 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.430000000000007 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.109999999999999 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.329999999999998 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.469 ' HH ' ' HB2' ' A' ' 11' ' ' PHE . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 75.420000000000002 111.536 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.209999999999994 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 73.349999999999994 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.420000000000002 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 55.450000000000003 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.239999999999995 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.099999999999994 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.340000000000003 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.319999999999993 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 . . . . . 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.129999999999995 111.801 -178.79 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-O 120.79 0.246 . . . . 73.219999999999999 112.546 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.420000000000002 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.239999999999995 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.200000000000003 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.404 ' HE1' ' HB2' ' A' ' 30' ' ' SER . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 63.030000000000001 110.91 177.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.140000000000001 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.049999999999997 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.491 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.420000000000002 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.239999999999995 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.230000000000004 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.319999999999993 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.409999999999997 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.400000000000006 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 73.099999999999994 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 73.510000000000005 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.230000000000004 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 75.439999999999998 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.010000000000005 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.540000000000006 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.340000000000003 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.491 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.510000000000005 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 53.530000000000001 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.430000000000007 111.784 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.430000000000007 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.404 ' HB2' ' HE1' ' A' ' 9' ' ' TYR . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.140000000000001 110.753 172.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.030000000000001 111.519 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 72.219999999999999 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.130000000000003 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.340000000000003 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.120000000000005 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.239999999999995 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.319999999999993 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 73.519999999999996 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.140000000000001 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.505 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.439999999999998 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 74.299999999999997 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.430000000000007 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.129999999999995 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.319999999999993 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.457 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.329999999999998 111.92 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.510000000000005 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.310000000000002 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.519 HG11 HG22 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.109999999999999 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.457 ' HE3' ' HG2' ' A' ' 46' ' ' ARG . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.450000000000003 111.269 176.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.140000000000001 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.450000000000003 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.310000000000002 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.109999999999999 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.420000000000002 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.510000000000005 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.149999999999999 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.340000000000003 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 71.129999999999995 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.100000000000001 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.140000000000001 111.147 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.519 HG22 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 73.409999999999997 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.310000000000002 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.417 ' N ' ' OD1' ' A' ' 63' ' ' ASN . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.239999999999995 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.010000000000005 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.412 HG21 ' HE3' ' A' ' 70' ' ' MET . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.219999999999999 111.179 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 75.430000000000007 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 61.100000000000001 111.463 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 73.400000000000006 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.412 ' HE3' HG21 ' A' ' 66' ' ' ILE . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.219999999999999 111.369 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 74.540000000000006 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.209999999999994 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.239999999999995 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.140000000000001 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 73.150000000000006 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.519999999999996 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.400000000000006 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.409999999999997 110.617 -179.926 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 N-CA-C 113.368 0.488 . . . . 38.159999999999997 113.368 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.239999999999995 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.230000000000004 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.310000000000002 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.019999999999996 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.420000000000002 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.66 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.319999999999993 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.584 ' HE1' ' HA ' ' A' ' 13' ' ' MET . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.539999999999999 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.400000000000006 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.219999999999999 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.140000000000001 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.030000000000001 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.439999999999998 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.239999999999995 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.200000000000003 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.219999999999999 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 38.159999999999997 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.420000000000002 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.53 ' HB2' HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.66 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.520000000000003 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.530000000000001 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.150000000000006 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 74.549999999999997 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.230000000000004 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.400000000000006 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.420000000000002 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.009999999999998 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 75.219999999999999 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.109999999999999 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 71.099999999999994 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 74.400000000000006 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.400000000000006 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.099999999999994 110.138 174.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.582 ' O ' HG23 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.099999999999994 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.403 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.219999999999999 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 74.409999999999997 112.498 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 70.109999999999999 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.209999999999994 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 75.010000000000005 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.019999999999996 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 71.120000000000005 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.459 HG21 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.420000000000002 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.459 ' N ' HG21 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 65.129999999999995 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.120000000000005 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.450000000000003 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.403 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 74.230000000000004 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.140000000000001 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.149999999999999 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.329999999999998 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 75.129999999999995 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.53 HD23 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.350000000000001 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.010000000000005 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 63.130000000000003 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.510000000000005 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.040000000000006 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.230000000000004 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.540000000000006 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.400000000000006 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.340000000000003 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 72.329999999999998 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 71.439999999999998 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 74.010000000000005 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.493 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.040000000000006 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.010000000000005 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.448 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.409999999999997 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 63.009999999999998 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.399999999999999 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.039999999999999 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.420000000000002 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.040000000000006 111.198 175.586 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.464 ' HB2' HG22 ' A' ' 7' ' ' THR . 56.4 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 N-CA-C 113.158 0.407 . . . . 65.239999999999995 113.158 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.149999999999999 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.464 HG22 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 72.530000000000001 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.423 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.319999999999993 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.435 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.239999999999995 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.430000000000007 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.420000000000002 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.140000000000001 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.239999999999995 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.409999999999997 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.350000000000001 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.409999999999997 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.310000000000002 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.129999999999995 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 73.540000000000006 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.409 ' HB3' HE22 ' A' ' 57' ' ' GLN . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.420000000000002 112.296 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.349999999999994 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.329999999999998 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 74.430000000000007 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.577 HD13 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.530000000000001 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 64.040000000000006 112.763 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.010000000000005 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 73.200000000000003 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 61.119999999999997 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.240000000000002 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.509999999999998 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.503 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.219999999999999 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.409999999999997 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.409999999999997 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.319999999999993 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.329999999999998 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.465 ' HB3' HG23 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 74.140000000000001 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.530000000000001 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.209999999999994 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.420000000000002 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.423 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 63.140000000000001 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.119999999999997 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.319999999999993 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.412 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.439999999999998 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.200000000000003 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.010000000000005 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.439999999999998 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.487 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 70.510000000000005 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.509999999999998 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 74.439999999999998 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 74.310000000000002 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.439999999999998 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.239999999999995 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.310000000000002 110.824 174.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.409 HE22 ' HB3' ' A' ' 21' ' ' PRO . 14.9 mm100 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.409999999999997 110.82 171.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.239999999999995 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 71.510000000000005 112.624 -177.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.664 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.310000000000002 111.672 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 64.400000000000006 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.466 HG22 HG12 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.230000000000004 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.664 HD22 ' HA ' ' A' ' 60' ' ' GLU . 11.1 p30 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.340000000000003 111.555 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.519999999999996 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.200000000000003 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.150000000000006 111.355 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 71.109999999999999 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.019999999999996 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.109999999999999 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.319999999999993 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.239999999999995 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 64.340000000000003 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.129999999999995 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.209999999999994 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.409999999999997 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.400000000000006 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.010000000000005 110.921 176.239 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 CA--C 1.545 1.07 0 N-CA-C 113.272 0.451 . . . . 71.549999999999997 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.319999999999993 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.299999999999997 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.430000000000007 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.229999999999997 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.129999999999995 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.635 HG12 HD11 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.019999999999996 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.019999999999996 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.240000000000002 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 73.200000000000003 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.436 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 72.209999999999994 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.099999999999994 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.340000000000003 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.120000000000005 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.120000000000005 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.219999999999999 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 64.040000000000006 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.349999999999994 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.350000000000001 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.635 HD11 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.525 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.200000000000003 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.510000000000005 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.439999999999998 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 74.230000000000004 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.129999999999995 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.140000000000001 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.229999999999997 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.409999999999997 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.530000000000001 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.540000000000006 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 73.310000000000002 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.420000000000002 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.601 ' HB2' HD12 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.099999999999994 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.577 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.229999999999997 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.577 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.420000000000002 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.589 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.510000000000005 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.120000000000005 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.601 HD12 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.409999999999997 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.420000000000002 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.020000000000003 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.310000000000002 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.541 HG12 HG22 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.510000000000005 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.200000000000003 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.299999999999997 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.239999999999995 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 74.109999999999999 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 50.130000000000003 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.520000000000003 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.349999999999994 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.239999999999995 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.401 HD21 HD22 ' A' ' 25' ' ' LEU . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.020000000000003 110.628 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.040000000000006 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.230000000000004 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 72.349999999999994 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.541 HG22 HG12 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 75.549999999999997 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.310000000000002 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.319999999999993 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.540000000000006 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 73.0 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.030000000000001 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.209999999999994 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.030000000000001 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.589 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.219999999999999 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.310000000000002 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.230000000000004 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.109999999999999 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.430000000000007 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.299999999999997 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.200000000000003 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.319999999999993 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.430000000000007 110.555 175.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo . . . . . 0 CA--C 1.545 1.065 0 CA-C-O 120.69 0.204 . . . . 74.349999999999994 112.435 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.606 ' HE1' ' HA ' ' A' ' 6' ' ' MET . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.209999999999994 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 74.120000000000005 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.420000000000002 111.655 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.59 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.319999999999993 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.439999999999998 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.319999999999993 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.553 HG13 ' HB3' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.230000000000004 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.200000000000003 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.219999999999999 112.893 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.400000000000006 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' HB2' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 64.5 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 75.319999999999993 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.239999999999995 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.420000000000002 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.049999999999997 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.510000000000005 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.420000000000002 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.340000000000003 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.479 HD23 HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 65.510000000000005 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.553 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 39.149999999999999 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.210000000000001 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.540000000000006 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.400000000000006 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.430000000000007 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.409999999999997 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.340000000000003 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.129999999999995 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.310000000000002 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 74.439999999999998 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.039999999999999 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.402 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.450000000000003 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.340000000000003 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.488 ' HB3' HD12 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.510000000000005 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.209999999999994 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.422 ' O ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.549999999999997 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 74.120000000000005 112.088 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.340000000000003 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 74.140000000000001 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.488 HD12 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.329999999999998 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 73.049999999999997 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.140000000000001 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.099999999999994 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.150000000000006 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.239999999999995 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.109999999999999 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.140000000000001 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.240000000000002 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.450000000000003 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.530000000000001 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.479 HD23 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.130000000000003 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.120000000000005 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.420000000000002 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.229999999999997 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.712 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.230000000000004 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 73.140000000000001 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.437 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.030000000000001 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 73.409999999999997 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.439999999999998 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.349999999999994 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 71.209999999999994 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.510000000000005 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.240000000000002 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.495 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 75.150000000000006 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.129999999999995 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.239999999999995 111.694 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.209999999999994 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.540000000000006 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.349999999999994 110.507 174.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 . . . . . 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.140000000000001 110.456 173.191 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HB2' HG22 ' A' ' 7' ' ' THR . 74.0 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 112.75 0.25 . . . . 74.230000000000004 112.75 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.430000000000007 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.43 HG22 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.099999999999994 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.448 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 74.019999999999996 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.430000000000007 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.409999999999997 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.529 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.329999999999998 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.686 HG13 ' HB1' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.219999999999999 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 71.430000000000007 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.539999999999999 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 72.209999999999994 111.023 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.209999999999994 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.150000000000006 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.530000000000001 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.229999999999997 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.219999999999999 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.120000000000005 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HB3' HD13 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.329999999999998 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 71.219999999999999 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 74.340000000000003 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.686 ' HB1' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.219999999999999 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.439999999999998 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.129999999999995 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 41.439999999999998 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 74.420000000000002 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.329999999999998 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.209999999999994 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.536 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.340000000000003 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.439999999999998 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.229999999999997 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.010000000000005 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 73.230000000000004 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.019999999999996 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.409999999999997 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.040000000000006 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.659 ' HB3' HD13 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.109999999999999 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.040000000000006 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 74.25 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.299999999999997 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.420000000000002 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.140000000000001 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 72.439999999999998 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.534 HG12 HG22 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 74.140000000000001 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.099999999999994 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.120000000000005 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.219999999999999 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.109999999999999 112.901 -172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 73.519999999999996 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.406 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.140000000000001 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.409999999999997 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.512 ' NE2' ' H ' ' A' ' 57' ' ' GLN . 2.1 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.530000000000001 111.375 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.109999999999999 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.340000000000003 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.522 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.240000000000002 112.448 -173.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.099999999999994 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.534 HG22 HG12 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.522 HD22 ' HA ' ' A' ' 60' ' ' GLU . 9.6 p30 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.210000000000001 111.609 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.420000000000002 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.540000000000006 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.659 HD13 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.340000000000003 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 72.430000000000007 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 51.030000000000001 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.529 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.409999999999997 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.340000000000003 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.230000000000004 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.120000000000005 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.030000000000001 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.409999999999997 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.239999999999995 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.230000000000004 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.310000000000002 114.829 170.72 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 CA--C 1.541 0.853 0 N-CA-C 113.321 0.47 . . . . 74.030000000000001 113.321 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.310000000000002 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 65.239999999999995 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.477 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.349999999999994 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 73.319999999999993 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 61.520000000000003 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.513 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.540000000000006 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.671 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 37.200000000000003 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.109999999999999 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.519999999999996 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.340000000000003 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 61.409999999999997 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.329999999999998 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.409999999999997 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.039999999999999 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 72.120000000000005 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.510000000000005 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.329999999999998 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.430000000000007 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.671 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.040000000000006 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.100000000000001 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.230000000000004 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.477 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 75.010000000000005 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.409999999999997 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.230000000000004 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.200000000000003 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.299999999999997 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.319999999999993 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.129999999999995 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.519999999999996 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.446 HD12 ' HH ' ' A' ' 48' ' ' TYR . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 111.705 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.119999999999997 112.927 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.040000000000006 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.120000000000005 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.441 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.219999999999999 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.450000000000003 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.049999999999997 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.239999999999995 111.214 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.475 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.230000000000004 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.613 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.129999999999995 111.342 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.446 ' HH ' HD12 ' A' ' 38' ' ' LEU . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 72.049999999999997 112.433 -178.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.621 HG12 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.219999999999999 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.613 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 74.019999999999996 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 75.25 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.329999999999998 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 75.310000000000002 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.109999999999999 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 71.329999999999998 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.420000000000002 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.549999999999997 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 71.120000000000005 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.634 ' HA ' HD22 ' A' ' 63' ' ' ASN . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.319999999999993 111.598 -176.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 72.140000000000001 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.621 HG21 HG12 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 75.230000000000004 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.634 HD22 ' HA ' ' A' ' 60' ' ' GLU . 9.4 p30 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.200000000000003 110.848 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.099999999999994 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.209999999999994 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 74.239999999999995 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.540000000000006 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 75.340000000000003 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.576 ' HE3' ' HA ' ' A' ' 70' ' ' MET . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.329999999999998 111.949 -176.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.540000000000006 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.420000000000002 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.140000000000001 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.049999999999997 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.420000000000002 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.130000000000003 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.439999999999998 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 74.530000000000001 109.94 174.805 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.9 mmm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.686 0.279 . . . . 71.230000000000004 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.0 127.6 32.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.995 0.426 . . . . 71.150000000000006 111.896 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.02 82.35 0.35 Allowed Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.196 -0.456 . . . . 53.200000000000003 112.042 177.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.87 98.17 32.62 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 112.393 0.516 . . . . 73.450000000000003 112.393 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.43 -20.32 5.94 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.323 2.016 . . . . 73.310000000000002 112.29 173.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 75.019999999999996 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 63.109999999999999 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.140000000000001 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.402 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 62.140000000000001 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.239999999999995 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 72.25 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.411 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.230000000000004 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.140000000000001 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.409999999999997 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.510000000000005 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.497 ' HB3' ' HB2' ' A' ' 26' ' ' ALA . 3.9 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 71.049999999999997 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.400000000000006 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.030000000000001 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.329999999999998 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.219999999999999 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.120000000000005 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 75.239999999999995 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.119999999999997 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 70.430000000000007 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.430000000000007 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 62.399999999999999 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.439999999999998 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.486 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 2.9 t60 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.150000000000006 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 73.230000000000004 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.140000000000001 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.486 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.209999999999994 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.310000000000002 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.549999999999997 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.310000000000002 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.209999999999994 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.030000000000001 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.319999999999993 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.030000000000001 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.150000000000006 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.510000000000005 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.109999999999999 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.430000000000007 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 63.049999999999997 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.129999999999995 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 73.439999999999998 110.851 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 64.109999999999999 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.758 HG21 HG22 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.329999999999998 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.679 ' HG2' HG21 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.400000000000006 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.240000000000002 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.530000000000001 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.409999999999997 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.109999999999999 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 75.439999999999998 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.210000000000001 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.549999999999997 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.409999999999997 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.679 HG21 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.010000000000005 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.552 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.439999999999998 111.823 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.109999999999999 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.758 HG22 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.430000000000007 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.552 HD22 ' HA ' ' A' ' 60' ' ' GLU . 11.0 p30 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.010000000000005 111.455 -176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.43 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.530000000000001 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.549999999999997 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.409999999999997 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.420000000000002 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.340000000000003 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.735 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.140000000000001 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.340000000000003 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.319999999999993 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.140000000000001 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 79' ' ' HIS . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.409999999999997 112.39 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 73.530000000000001 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 74.519999999999996 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -134.02 101.82 5.19 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 74.129999999999995 109.866 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.421 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 16.4 t-80 -132.54 86.86 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.179 0.437 . . . . 74.340000000000003 112.179 -176.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.5 -0.762 . . . . 64.510000000000005 112.534 178.559 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.433 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.762 0.315 . . . . 71.109999999999999 110.535 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.04 59.74 3.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.491 0.662 . . . . 61.219999999999999 110.197 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.87 172.06 20.88 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.341 -0.845 . . . . 50.119999999999997 111.162 -173.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.29 83.33 0.23 Allowed Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 117.113 0.457 . . . . 71.209999999999994 110.751 -176.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo -58.77 -22.64 62.66 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.668 2.245 . . . . 55.340000000000003 113.701 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.140000000000001 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.519999999999996 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 74.299999999999997 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.479 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.430000000000007 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.310000000000002 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.140000000000001 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.030000000000001 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.329999999999998 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.540000000000006 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.120000000000005 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.130000000000003 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.120000000000005 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 75.200000000000003 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.150000000000006 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.239999999999995 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.340000000000003 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.219999999999999 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.530000000000001 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.531 HD11 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.109999999999999 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.548 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.130000000000003 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.200000000000003 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.329999999999998 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.030000000000001 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.010000000000005 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.230000000000004 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.230000000000004 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.120000000000005 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.439999999999998 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 70.230000000000004 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.349999999999994 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 70.120000000000005 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.109999999999999 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.515 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.129999999999995 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.340000000000003 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.530000000000001 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.450000000000003 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.009999999999998 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.010000000000005 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 72.010000000000005 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 72.109999999999999 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.450000000000003 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.200000000000003 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 75.099999999999994 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.310000000000002 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.010000000000005 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.431 HD21 ' N ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.209999999999994 112.106 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 74.140000000000001 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.049999999999997 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.319999999999993 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.409999999999997 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.409999999999997 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.46 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.120000000000005 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.239999999999995 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.310000000000002 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.129999999999995 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.120000000000005 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.120000000000005 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.299999999999997 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.414 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.450000000000003 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.310000000000002 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.019999999999996 111.267 175.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.510000000000005 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.209999999999994 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.409999999999997 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.030000000000001 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.549999999999997 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.25 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.109999999999999 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.540000000000006 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 63.350000000000001 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 65.13 96.5 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 74.450000000000003 113.305 173.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -156.02 127.06 6.99 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.262 -0.426 . . . . 64.200000000000003 111.475 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.626 -0.702 . . . . 74.340000000000003 110.711 175.478 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.484 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.7 0.286 . . . . 74.239999999999995 111.389 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.25 86.92 3.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.197 0.523 . . . . 74.120000000000005 111.458 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 140.16 -164.7 26.15 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 116.045 -0.525 . . . . 71.219999999999999 112.271 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -148.78 99.37 3.54 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 117.387 0.594 . . . . 73.219999999999999 112.193 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.697 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo -79.17 -7.14 15.14 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.126 2.551 . . . . 63.229999999999997 112.217 171.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.439999999999998 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.420000000000002 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.219999999999999 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.340000000000003 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 74.420000000000002 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.129999999999995 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.040000000000006 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.530000000000001 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.109999999999999 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.42 ' OE1' ' HB1' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.519999999999996 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.140000000000001 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.530000000000001 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.450000000000003 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.099999999999994 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.439999999999998 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.230000000000004 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.120000000000005 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.329999999999998 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.209999999999994 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.42 ' HB1' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.030000000000001 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.409999999999997 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.329999999999998 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.030000000000001 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.400000000000006 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.310000000000002 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.439999999999998 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.209999999999994 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 74.349999999999994 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.430000000000007 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.491 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.400000000000006 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.421 HD21 ' O ' ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.519999999999996 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.540000000000006 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.697 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.319999999999993 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.577 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.230000000000004 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.109999999999999 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.329999999999998 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.420000000000002 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.319999999999993 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 62.219999999999999 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.310000000000002 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.239999999999995 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.543 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 74.120000000000005 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.420000000000002 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.399999999999999 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.010000000000005 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.543 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.239999999999995 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.310000000000002 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.200000000000003 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.420000000000002 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.239999999999995 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 74.239999999999995 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.439999999999998 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.340000000000003 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.439999999999998 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.455 ' OG1' HG12 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.409999999999997 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.449 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.140000000000001 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.43 ' O ' HD21 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.430000000000007 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.219999999999999 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.150000000000006 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.400000000000006 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.43 HD21 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.310000000000002 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.150000000000006 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.450000000000003 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.340000000000003 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.329999999999998 110.997 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.430000000000007 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.439999999999998 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.140000000000001 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.209999999999994 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.44 111.61 2.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.450000000000003 110.901 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 58.64 62.52 1.92 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 121.262 0.553 . . . . 71.450000000000003 110.711 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.407 -0.806 . . . . 62.229999999999997 111.333 -179.716 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.587 0.232 . . . . 62.219999999999999 111.081 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.41 150.17 21.38 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.806 0.336 . . . . 42.409999999999997 111.252 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.45 -175.07 34.2 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 121.055 -0.593 . . . . 74.519999999999996 114.295 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.8 t70 62.02 111.08 0.03 OUTLIER Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.955 0.902 . . . . 71.519999999999996 113.241 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.588 ' HD2' HG21 ' A' ' 7' ' ' THR . 4.6 Cg_exo -79.41 38.66 0.75 Allowed 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.101 2.534 . . . . 75.450000000000003 112.801 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.439999999999998 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.588 HG21 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.530000000000001 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.510000000000005 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 74.340000000000003 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.619 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.350000000000001 111.767 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.558 ' HB2' ' HH ' ' A' ' 69' ' ' TYR . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.219999999999999 112.124 -177.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.602 HG13 ' HB3' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.019999999999996 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.619 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.109999999999999 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.140000000000001 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.484 HE21 ' HB2' ' A' ' 26' ' ' ALA . 8.3 tp-100 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.010000000000005 111.438 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.209999999999994 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.439999999999998 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.400000000000006 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.465 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.510000000000005 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.140000000000001 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.329999999999998 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.420000000000002 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.240000000000002 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.329999999999998 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.602 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.540000000000006 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.129999999999995 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.44 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.530000000000001 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.120000000000005 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.319999999999993 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.310000000000002 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.230000000000004 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.040000000000006 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.340000000000003 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.414 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.420000000000002 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.119999999999997 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 72.400000000000006 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.439999999999998 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.518 ' HB3' HD12 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.099999999999994 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.661 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.349999999999994 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.661 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.430000000000007 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 75.510000000000005 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.230000000000004 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.557 HG21 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 74.340000000000003 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.518 HD12 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 74.030000000000001 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.120000000000005 111.509 -178.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.525 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.049999999999997 112.015 179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.430000000000007 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.428 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.239999999999995 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.525 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.109999999999999 111.915 -179.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 74.349999999999994 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.230000000000004 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.140000000000001 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.340000000000003 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.239999999999995 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.200000000000003 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.439999999999998 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.299999999999997 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.428 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.420000000000002 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.299999999999997 112.657 -171.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 75.439999999999998 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.209999999999994 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.329999999999998 111.38 176.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.140000000000001 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.120000000000005 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 75.120000000000005 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.120000000000005 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.420000000000002 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.558 ' HH ' ' HB2' ' A' ' 11' ' ' PHE . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 73.530000000000001 111.935 179.694 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.099999999999994 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.129999999999995 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.120000000000005 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.120000000000005 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.219999999999999 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.319999999999993 111.693 -177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.420000000000002 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.129999999999995 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -85.59 77.1 9.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.340000000000003 110.224 179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -60.78 -54.19 48.21 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.088 0.403 . . . . 44.240000000000002 112.088 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.615 -0.707 . . . . 71.310000000000002 111.389 178.685 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.8 mmm . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.999 0.428 . . . . 62.0 111.0 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.8 87.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.247 -0.433 . . . . 74.030000000000001 110.732 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.26 -59.99 3.18 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.149 -0.548 . . . . 70.530000000000001 112.57 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.497 ' HB3' ' HE1' ' A' ' 6' ' ' MET . 14.1 m-20 53.81 75.61 0.61 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.259 0.624 . . . . 74.510000000000005 112.292 174.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo -65.03 -51.77 1.47 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.466 2.111 . . . . 51.450000000000003 112.542 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.497 ' HE1' ' HB3' ' A' ' 4' ' ' ASP . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.329999999999998 112.685 178.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.140000000000001 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.329999999999998 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.593 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 65.109999999999999 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.658 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 2.6 t-20 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.209999999999994 111.489 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.030000000000001 111.997 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.503 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.658 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.340000000000003 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.310000000000002 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 74.420000000000002 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.209999999999994 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 70.120000000000005 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 75.329999999999998 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.510000000000005 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 74.140000000000001 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 71.040000000000006 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 73.439999999999998 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.109999999999999 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.150000000000006 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.439999999999998 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.503 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.230000000000004 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.430000000000007 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.409999999999997 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.329999999999998 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 61.32 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.420000000000002 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.040000000000006 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.545 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.200000000000003 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.399999999999999 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.540000000000006 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.509999999999998 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.200000000000003 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.209999999999994 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.129999999999995 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.140000000000001 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.571 ' O ' HG23 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.540000000000006 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.58 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 73.430000000000007 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.420000000000002 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.299999999999997 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.549999999999997 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.420000000000002 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.310000000000002 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.340000000000003 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.530000000000001 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 42.409999999999997 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.299999999999997 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.428 HD21 ' N ' ' A' ' 52' ' ' ASN . 0.9 OUTLIER -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.310000000000002 113.168 -176.516 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 75.109999999999999 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.109999999999999 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.444 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 73.540000000000006 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.340000000000003 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 71.299999999999997 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.040000000000006 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.349999999999994 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 75.030000000000001 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 75.400000000000006 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.4 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.409999999999997 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 72.200000000000003 112.227 -173.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 74.349999999999994 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.540000000000006 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.58 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.530000000000001 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.510000000000005 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.209999999999994 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.409999999999997 111.77 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.230000000000004 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.149999999999999 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 75.049999999999997 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 75.230000000000004 110.939 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.430000000000007 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 75.230000000000004 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 72.129999999999995 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.209999999999994 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -78.69 -25.84 44.83 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.439999999999998 110.978 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.5 m80 61.99 -178.38 0.13 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.891 -0.595 . . . . 73.299999999999997 112.602 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.342 -0.837 . . . . 75.219999999999999 111.414 176.983 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.781 0.324 . . . . 72.109999999999999 111.66 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.43 80.18 1.04 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.336 0.589 . . . . 72.230000000000004 111.81 -178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.452 ' HA3' ' HG ' ' A' ' 38' ' ' LEU . . . -100.94 37.5 3.57 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-N 116.085 -0.507 . . . . 54.329999999999998 112.809 178.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.466 ' N ' ' CD ' ' A' ' 5' ' ' PRO . 13.5 m-20 -128.29 33.05 0.23 Allowed Pre-proline 0 CA--C 1.553 1.081 0 N-CA-C 113.969 1.1 . . . . 75.430000000000007 113.969 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' CD ' ' N ' ' A' ' 4' ' ' ASP . 38.7 Cg_endo -66.27 -51.41 1.11 Allowed 'Trans proline' 0 C--N 1.363 1.332 0 CA-C-N 120.951 1.375 . . . . 71.510000000000005 111.67 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.140000000000001 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.030000000000001 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.319999999999993 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.54 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.310000000000002 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.219999999999999 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.209999999999994 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.454 HD12 ' HB3' ' A' ' 22' ' ' PHE . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.140000000000001 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.409999999999997 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.119999999999997 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 74.230000000000004 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.310000000000002 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.129999999999995 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.319999999999993 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.019999999999996 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.140000000000001 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.209999999999994 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.454 ' HB3' HD12 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 74.450000000000003 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.200000000000003 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.109999999999999 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 71.209999999999994 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.438 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.340000000000003 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.239999999999995 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 72.439999999999998 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.400000000000006 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.405 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 36.810000000000002 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.329999999999998 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 74.129999999999995 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.030000000000001 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.450000000000003 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.420000000000002 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.129999999999995 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.399999999999999 112.641 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.452 ' HG ' ' HA3' ' A' ' 3' ' ' GLY . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 71.340000000000003 111.743 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 73.219999999999999 113.159 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.040000000000006 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.310000000000002 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.439999999999998 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.447 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.109999999999999 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 62.25 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.009999999999998 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.109999999999999 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.329999999999998 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 74.129999999999995 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.400000000000006 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.120000000000005 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.349999999999994 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.120000000000005 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 74.040000000000006 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.399999999999999 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.540000000000006 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 73.099999999999994 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.010000000000005 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.554 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.510000000000005 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.120000000000005 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 75.319999999999993 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.420000000000002 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.030000000000001 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.319999999999993 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.510000000000005 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.329999999999998 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 64.219999999999999 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 60.450000000000003 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 72.230000000000004 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.340000000000003 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.040000000000006 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.530000000000001 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.319999999999993 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.510000000000005 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 74.439999999999998 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.439999999999998 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -94.27 -28.21 15.72 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.430000000000007 110.737 175.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -141.43 -168.17 2.58 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.79 0.436 . . . . 71.519999999999996 111.391 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.85 -0.595 . . . . 75.230000000000004 111.994 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.548 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.8 mpp? . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.518 0.199 . . . . 72.530000000000001 110.711 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.8 90.19 3.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 120.878 0.371 . . . . 70.219999999999999 111.821 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 66.66 -90.88 0.17 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.347 -0.454 . . . . 70.239999999999995 113.531 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -110.06 99.77 40.76 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-O 121.264 0.554 . . . . 74.540000000000006 111.745 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.55 -51.25 0.1 OUTLIER 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 122.525 2.15 . . . . 75.329999999999998 113.261 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.049999999999997 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 71.299999999999997 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 75.319999999999993 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 71.010000000000005 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.140000000000001 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.120000000000005 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.404 HG12 HD12 ' A' ' 25' ' ' LEU . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.539999999999999 112.381 -174.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 72.340000000000003 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.310000000000002 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.230000000000004 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.635 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.340000000000003 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.329999999999998 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.230000000000004 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.230000000000004 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.109999999999999 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.340000000000003 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 74.109999999999999 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.130000000000003 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 75.239999999999995 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.404 HD12 HG12 ' A' ' 12' ' ' ILE . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.409999999999997 110.288 176.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.430000000000007 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.635 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.349999999999994 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.450000000000003 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.487 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.120000000000005 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.120000000000005 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.120000000000005 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.109999999999999 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.340000000000003 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.420000000000002 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.530000000000001 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.109999999999999 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.519999999999996 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.340000000000003 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.519999999999996 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.428 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.450000000000003 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.219999999999999 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.140000000000001 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.010000000000005 112.421 -179.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.319999999999993 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.319999999999993 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HB2' HG22 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.310000000000002 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.609 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.129999999999995 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.420000000000002 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.597 HG13 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 64.510000000000005 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.609 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.510000000000005 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.219999999999999 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.009999999999998 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.413 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.439999999999998 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.040000000000006 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 60.420000000000002 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 75.129999999999995 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.420000000000002 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.329999999999998 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.209999999999994 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.019999999999996 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.439999999999998 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.597 HG21 HG13 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.450000000000003 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.200000000000003 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.329999999999998 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.42 HG22 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.230000000000004 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.239999999999995 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.209999999999994 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.430000000000007 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.129999999999995 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.44 ' HA ' ' HD1' ' A' ' 75' ' ' HIS . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.319999999999993 110.498 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 73.040000000000006 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.400000000000006 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.44 ' HD1' ' HA ' ' A' ' 72' ' ' ASN . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 75.430000000000007 111.658 177.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.239999999999995 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 75.299999999999997 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -103.15 80.08 1.81 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.240000000000002 109.205 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -64.89 -49.2 71.41 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.116 -0.493 . . . . 74.329999999999998 111.15 -174.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-N 116.57 -0.287 . . . . 73.200000000000003 111.471 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.524 ' N ' ' SD ' ' A' ' 1' ' ' MET . 3.2 mpp? . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 120.754 0.311 . . . . 71.439999999999998 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.07 97.13 3.35 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.898 0.38 . . . . 74.430000000000007 111.77 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.81 40.98 2.25 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 121.315 -0.469 . . . . 73.439999999999998 112.532 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.454 ' HB3' ' HA ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -150.67 61.77 4.88 Favored Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 112.389 0.514 . . . . 74.239999999999995 112.389 -176.412 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -70.25 11.03 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 122.62 2.214 . . . . 74.219999999999999 113.855 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.644 ' HA ' ' HE2' ' A' ' 6' ' ' MET . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.420000000000002 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.430000000000007 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.340000000000003 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.484 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.200000000000003 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.230000000000004 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.299999999999997 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.473 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 74.510000000000005 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.109999999999999 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.130000000000003 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.129999999999995 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HB2' ' HB1' ' A' ' 26' ' ' ALA . 0.0 OUTLIER -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.519999999999996 111.575 -177.002 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 70.200000000000003 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.420000000000002 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.557 ' N ' HD21 ' A' ' 19' ' ' ASN . 0.8 OUTLIER -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.549999999999997 113.587 -164.36 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 53.329999999999998 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.229999999999997 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 73.25 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 38.159999999999997 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.239999999999995 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.450000000000003 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.473 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.430000000000007 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 73.150000000000006 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.240000000000002 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.603 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.040000000000006 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.019999999999996 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.140000000000001 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.603 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.230000000000004 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.329999999999998 111.094 173.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.540000000000006 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.439999999999998 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 73.150000000000006 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.579 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 75.519999999999996 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.454 ' HA ' ' HB3' ' A' ' 4' ' ' ASP . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.030000000000001 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 74.409999999999997 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.120000000000005 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.444 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.310000000000002 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.642 ' HB3' HD13 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.219999999999999 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.310000000000002 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.099999999999994 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.439999999999998 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.329999999999998 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.209999999999994 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.319999999999993 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.526 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.409999999999997 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.45 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.319999999999993 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 72.099999999999994 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 75.519999999999996 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.526 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.530000000000001 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.44 HG21 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.150000000000006 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.44 ' H ' HG21 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.209999999999994 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.439999999999998 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.439999999999998 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.549999999999997 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.45 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 73.530000000000001 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.030000000000001 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.310000000000002 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 75.439999999999998 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 71.510000000000005 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.450000000000003 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.010000000000005 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.642 HD13 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.409999999999997 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 74.109999999999999 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.319999999999993 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 71.109999999999999 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.608 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.209999999999994 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.119999999999997 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.310000000000002 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.329999999999998 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.530000000000001 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 64.230000000000004 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.109999999999999 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 75.040000000000006 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.416 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 70.56 -52.62 0.66 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.200000000000003 112.476 -175.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.18 107.49 1.58 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.326 0.491 . . . . 72.329999999999998 112.326 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 123.41 0.684 . . . . 74.319999999999993 112.775 177.391 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.6 mpp? . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.726 0.298 . . . . 72.239999999999995 111.226 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.98 148.19 42.32 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.892 0.377 . . . . 65.5 111.909 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.47 174.76 49.99 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 120.898 -0.668 . . . . 71.109999999999999 112.855 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.443 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 21.0 t70 70.06 116.38 0.03 OUTLIER Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 122.91 0.484 . . . . 73.310000000000002 111.736 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.7 Cg_endo -85.84 -68.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.194 2.596 . . . . 62.5 113.847 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.209999999999994 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.450000000000003 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.319999999999993 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 74.540000000000006 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.420000000000002 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.230000000000004 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.299999999999997 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.409999999999997 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.239999999999995 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.430000000000007 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.540000000000006 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.149999999999999 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.450000000000003 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.519999999999996 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.319999999999993 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.120000000000005 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.519999999999996 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.329999999999998 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.120000000000005 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.200000000000003 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.400000000000006 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.109999999999999 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.530000000000001 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.430000000000007 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 74.530000000000001 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.140000000000001 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.469 ' HB3' ' HZ1' ' A' ' 33' ' ' LYS . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.25 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.439999999999998 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.441 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.420000000000002 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.040000000000006 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.430000000000007 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.542 ' O ' HG23 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.140000000000001 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.519 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.099999999999994 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.340000000000003 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.439999999999998 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.445 HD11 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.310000000000002 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.329999999999998 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.340000000000003 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.426 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.450000000000003 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.568 HG12 HG22 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.439999999999998 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.040000000000006 110.974 174.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.140000000000001 111.87 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 51.109999999999999 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.019999999999996 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.129999999999995 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.200000000000003 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.439999999999998 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.129999999999995 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.120000000000005 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.439999999999998 112.313 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.400000000000006 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.420000000000002 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.568 HG22 HG12 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 64.099999999999994 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.200000000000003 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 74.129999999999995 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.510000000000005 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.519 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.340000000000003 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.109999999999999 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.340000000000003 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.400000000000006 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.319999999999993 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.140000000000001 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.019999999999996 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.030000000000001 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.040000000000006 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.219999999999999 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 70.5 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -103.69 125.26 50.07 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.150000000000006 112.406 178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -102.19 -55.39 2.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.254 -1.017 . . . . 74.549999999999997 108.254 166.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 . . . . . 0 C--O 1.255 1.372 0 CA-C-N 114.722 -1.127 . . . . 70.340000000000003 109.815 170.506 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.388 0.137 . . . . 61.119999999999997 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.8 22.9 3.46 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.459 0.541 . . . . 73.400000000000006 112.459 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 113.74 -42.89 1.82 Allowed Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.43 -0.414 . . . . 74.439999999999998 112.82 -176.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.75 117.37 55.09 Favored Pre-proline 0 CA--C 1.543 0.709 0 O-C-N 122.619 -0.342 . . . . 73.040000000000006 111.0 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.34 -17.35 49.5 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.808 2.339 . . . . 74.140000000000001 113.199 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.613 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.239999999999995 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.525 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 71.120000000000005 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.613 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.030000000000001 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.420000000000002 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.678 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.439999999999998 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.240000000000002 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.140000000000001 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.120000000000005 111.207 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.400000000000006 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.409999999999997 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.119999999999997 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 73.299999999999997 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.310000000000002 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.540000000000006 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.020000000000003 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.329999999999998 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.240000000000002 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.678 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.299999999999997 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.099999999999994 111.529 -177.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.340000000000003 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.230000000000004 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.240000000000002 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.150000000000006 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.349999999999994 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.019999999999996 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.310000000000002 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.430000000000007 112.578 175.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.400000000000006 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.109999999999999 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.239999999999995 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.340000000000003 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.129999999999995 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.129999999999995 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.230000000000004 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.340000000000003 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.540000000000006 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.340000000000003 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.219999999999999 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.530000000000001 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.420000000000002 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.209999999999994 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.109999999999999 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.019999999999996 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 70.150000000000006 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.409999999999997 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.209999999999994 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.409999999999997 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.299999999999997 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 74.310000000000002 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.109999999999999 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.140000000000001 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.519999999999996 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.140000000000001 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.510000000000005 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 70.349999999999994 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 74.109999999999999 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.299999999999997 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.525 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 74.239999999999995 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 64.239999999999995 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 38.82 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.010000000000005 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.040000000000006 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.349999999999994 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 75.030000000000001 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.209999999999994 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.549999999999997 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -123.31 99.87 6.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.549999999999997 111.701 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.26 126.92 34.65 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.498 -0.319 . . . . 74.450000000000003 110.415 172.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.491 -0.766 . . . . 71.510000000000005 111.953 -178.14 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.403 ' HG2' ' H ' ' A' ' 3' ' ' GLY . 26.9 ttt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 120.422 0.153 . . . . 74.319999999999993 110.763 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.89 -15.12 35.17 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.104 0.478 . . . . 42.299999999999997 111.764 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.403 ' H ' ' HG2' ' A' ' 1' ' ' MET . . . -101.67 -163.35 27.07 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.378 -0.439 . . . . 61.43 112.981 176.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -129.91 116.55 18.04 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.365 0.506 . . . . 63.340000000000003 112.365 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -101.68 9.37 0.49 Allowed 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 123.354 2.703 . . . . 61.439999999999998 112.702 168.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.439999999999998 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.349999999999994 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 74.230000000000004 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.404 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.229999999999997 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 75.409999999999997 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.404 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.510000000000005 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.200000000000003 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 73.310000000000002 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.420000000000002 111.519 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.130000000000003 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.409999999999997 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.349999999999994 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 36.780000000000001 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.539 ' HD1' HG22 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 73.439999999999998 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 36.780000000000001 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.420000000000002 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 72.549999999999997 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 74.349999999999994 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 71.450000000000003 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.431 HG13 ' HH ' ' A' ' 53' ' ' TYR . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 71.230000000000004 111.131 176.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.319999999999993 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.420000000000002 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.420000000000002 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.430000000000007 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.209999999999994 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.049999999999997 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.030000000000001 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.310000000000002 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.73 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.349999999999994 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.519999999999996 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.544 ' O ' HG21 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.340000000000003 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.534 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 74.010000000000005 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.329999999999998 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.544 HG21 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 64.329999999999998 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.73 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.140000000000001 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.120000000000005 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.510000000000005 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.420000000000002 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.631 HG23 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.329999999999998 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.64 ' HG2' HG21 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.430000000000007 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.340000000000003 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.040000000000006 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.431 ' HH ' HG13 ' A' ' 29' ' ' VAL . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.519999999999996 112.164 -174.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.319999999999993 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.430000000000007 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.140000000000001 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.219999999999999 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.099999999999994 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.64 HG21 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.039999999999999 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.530000000000001 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.539 HG22 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 74.450000000000003 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.631 HG21 HG23 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.430000000000007 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.406 ' ND2' HG22 ' A' ' 59' ' ' ILE . 94.3 m-20 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 72.219999999999999 112.025 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.540000000000006 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.349999999999994 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.473 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.439999999999998 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 75.239999999999995 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.420000000000002 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.534 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.310000000000002 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.019999999999996 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.219999999999999 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.240000000000002 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.349999999999994 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.020000000000003 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.540000000000006 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.439999999999998 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.129999999999995 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -118.71 171.36 8.25 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.439999999999998 110.759 172.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.8 m80 -145.83 173.61 11.97 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.975 0.417 . . . . 62.109999999999999 111.364 178.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.759 -0.639 . . . . 64.030000000000001 112.012 -179.232 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.537 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 120.772 0.32 . . . . 73.340000000000003 111.594 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.68 169.17 16.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.855 0.36 . . . . 74.209999999999994 111.692 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.9 89.85 0.35 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.1 -0.571 . . . . 74.200000000000003 112.723 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.72 122.97 72.26 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.462 0.541 . . . . 65.439999999999998 112.462 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -95.31 -9.29 1.3 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.121 2.548 . . . . 73.129999999999995 113.174 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.310000000000002 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.530000000000001 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.421 ' HZ ' HD13 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.109999999999999 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.538 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 71.230000000000004 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.631 ' HA ' ' HE2' ' A' ' 13' ' ' MET . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.340000000000003 111.662 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 73.200000000000003 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.648 HG12 HD12 ' A' ' 25' ' ' LEU . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.409999999999997 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.631 ' HE2' ' HA ' ' A' ' 10' ' ' ASN . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.040000000000006 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.140000000000001 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.219999999999999 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.239999999999995 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.129999999999995 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.229999999999997 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 75.340000000000003 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.409999999999997 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.519999999999996 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.109999999999999 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.049999999999997 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.648 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.420000000000002 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.635 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.030000000000001 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.450000000000003 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 73.409999999999997 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.409999999999997 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.400000000000006 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.219999999999999 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.129999999999995 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.120000000000005 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 74.120000000000005 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.340000000000003 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.450000000000003 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.200000000000003 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.626 ' HA ' HD13 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.409999999999997 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' HG23 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.420000000000002 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.229999999999997 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.310000000000002 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.400000000000006 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.626 HD13 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.439999999999998 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.020000000000003 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.340000000000003 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 72.25 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 70.519999999999996 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 36.5 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.129999999999995 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 51.130000000000003 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 71.010000000000005 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.319999999999993 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.456 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.129999999999995 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.530000000000001 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.010000000000005 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.130000000000003 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.219999999999999 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.540000000000006 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.549999999999997 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.039999999999999 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.219999999999999 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.140000000000001 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.439999999999998 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.140000000000001 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.478 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.210000000000001 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.340000000000003 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.450000000000003 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.120000000000005 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.478 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.409999999999997 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.130000000000003 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.109999999999999 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 75.519999999999996 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.239999999999995 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.299999999999997 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -77.15 92.1 3.77 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 72.030000000000001 111.257 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -68.83 148.17 50.66 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.153 -0.476 . . . . 75.349999999999994 111.047 174.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.273 -0.87 . . . . 73.430000000000007 111.778 -177.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.493 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.731 0.3 . . . . 75.030000000000001 111.488 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.7 -20.7 66.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.169 0.803 . . . . 42.229999999999997 113.169 -174.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.16 -79.73 1.02 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 121.07 -0.586 . . . . 37.479999999999997 113.305 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.05 90.07 2.52 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.401 0.62 . . . . 64.430000000000007 111.723 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.656 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo -89.26 -56.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.591 2.194 . . . . 41.409999999999997 114.67 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 75.230000000000004 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 74.099999999999994 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.319999999999993 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.150000000000006 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.469 ' HB2' ' HH ' ' A' ' 69' ' ' TYR . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.510000000000005 111.454 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.400000000000006 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.140000000000001 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.420000000000002 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.409999999999997 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.439999999999998 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.519999999999996 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.010000000000005 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.310000000000002 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.519999999999996 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.230000000000004 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.498 ' HB3' HD13 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.140000000000001 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.349999999999994 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.439999999999998 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.430000000000007 111.889 179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.540000000000006 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.430000000000007 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.518 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.340000000000003 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.319999999999993 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.450000000000003 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.450000000000003 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.708 ' HZ2' ' HB3' ' A' ' 33' ' ' LYS . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 71.450000000000003 110.249 172.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.109999999999999 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.416 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 74.019999999999996 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.239999999999995 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.416 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.100000000000001 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.425 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.400000000000006 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.530000000000001 111.939 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.409999999999997 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.510000000000005 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.563 ' HB3' HG21 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.019999999999996 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.219999999999999 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.219999999999999 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.447 ' HB ' HD13 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.329999999999998 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.439999999999998 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.200000000000003 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.319999999999993 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.475 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.120000000000005 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.519999999999996 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.099999999999994 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.329999999999998 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.549999999999997 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.119999999999997 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.540000000000006 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 71.319999999999993 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.109999999999999 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.426 HG22 ' OD1' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.439999999999998 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.475 ' HA ' HD22 ' A' ' 63' ' ' ASN . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.230000000000004 112.182 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.540000000000006 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.409999999999997 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.614 HD21 ' N ' ' A' ' 64' ' ' ARG . 0.3 OUTLIER -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.319999999999993 112.729 -173.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.614 ' N ' HD21 ' A' ' 63' ' ' ASN . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.109999999999999 110.724 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.030000000000001 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.563 HG21 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.430000000000007 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.109999999999999 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.329999999999998 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.469 ' HH ' ' HB2' ' A' ' 11' ' ' PHE . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 75.420000000000002 111.536 177.215 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.209999999999994 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 73.349999999999994 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.420000000000002 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 55.450000000000003 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.239999999999995 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.099999999999994 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.340000000000003 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.319999999999993 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 59.33 -173.59 0.1 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.129999999999995 111.801 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -131.14 1.11 4.21 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.118 0.485 . . . . 72.299999999999997 110.408 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-N 116.05 -0.523 . . . . 53.439999999999998 110.649 178.374 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.6 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 120.915 0.388 . . . . 75.400000000000006 111.545 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.14 107.76 9.55 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.89 0.376 . . . . 73.329999999999998 111.019 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.07 -74.65 1.99 Allowed Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.103 -0.57 . . . . 75.319999999999993 112.799 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -169.46 106.35 0.47 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 120.719 0.295 . . . . 74.540000000000006 111.263 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.91 -20.11 34.53 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.558 2.172 . . . . 73.219999999999999 112.546 175.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.420000000000002 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.239999999999995 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.200000000000003 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.404 ' HE1' ' HB2' ' A' ' 30' ' ' SER . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 63.030000000000001 110.91 177.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.140000000000001 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.049999999999997 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.491 HG13 ' HB3' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.420000000000002 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.239999999999995 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.230000000000004 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.319999999999993 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.409999999999997 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.400000000000006 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 73.099999999999994 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 73.510000000000005 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.230000000000004 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.414 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 75.439999999999998 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.010000000000005 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.540000000000006 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.340000000000003 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.491 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.510000000000005 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 53.530000000000001 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.430000000000007 111.784 177.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.430000000000007 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.404 ' HB2' ' HE1' ' A' ' 9' ' ' TYR . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.140000000000001 110.753 172.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.030000000000001 111.519 178.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 72.219999999999999 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.130000000000003 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.340000000000003 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.140000000000001 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.120000000000005 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.239999999999995 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.319999999999993 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 73.519999999999996 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.140000000000001 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.505 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.439999999999998 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 74.299999999999997 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.430000000000007 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.129999999999995 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.319999999999993 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.457 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.329999999999998 111.92 -178.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.510000000000005 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.310000000000002 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.519 HG11 HG22 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.109999999999999 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.457 ' HE3' ' HG2' ' A' ' 46' ' ' ARG . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.450000000000003 111.269 176.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.140000000000001 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.450000000000003 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.310000000000002 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.109999999999999 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.420000000000002 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.510000000000005 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.149999999999999 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.340000000000003 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 71.129999999999995 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.100000000000001 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.140000000000001 111.147 174.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.519 HG22 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 73.409999999999997 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.310000000000002 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.417 ' N ' ' OD1' ' A' ' 63' ' ' ASN . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.239999999999995 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.010000000000005 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.412 HG21 ' HE3' ' A' ' 70' ' ' MET . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.219999999999999 111.179 176.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 75.430000000000007 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 61.100000000000001 111.463 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 73.400000000000006 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.412 ' HE3' HG21 ' A' ' 66' ' ' ILE . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.219999999999999 111.369 175.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 74.540000000000006 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.209999999999994 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.239999999999995 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.140000000000001 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 73.150000000000006 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.519999999999996 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.400000000000006 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -144.63 87.75 1.88 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.409999999999997 110.617 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -93.4 -18.24 22.59 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.098 0.475 . . . . 75.129999999999995 110.982 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 25.9 m80 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 118.637 -0.697 . . . . 75.040000000000006 110.892 174.287 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.469 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.644 0.259 . . . . 73.140000000000001 111.179 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.52 29.04 18.17 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.726 0.41 . . . . 71.510000000000005 111.979 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.71 179.11 35.5 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.771 -0.728 . . . . 73.120000000000005 113.908 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -163.05 74.61 1.96 Allowed Pre-proline 0 CA--C 1.547 0.854 0 CA-C-O 121.341 0.591 . . . . 70.209999999999994 111.001 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.63 -59.82 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.012 2.475 . . . . 38.159999999999997 113.368 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.239999999999995 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.230000000000004 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.310000000000002 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.019999999999996 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.420000000000002 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.66 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.319999999999993 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.584 ' HE1' ' HA ' ' A' ' 13' ' ' MET . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.539999999999999 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.400000000000006 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.219999999999999 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.140000000000001 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.030000000000001 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.439999999999998 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.239999999999995 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.200000000000003 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.219999999999999 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 38.159999999999997 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.420000000000002 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.53 ' HB2' HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.66 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.520000000000003 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.530000000000001 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.150000000000006 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 74.549999999999997 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.230000000000004 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.400000000000006 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.420000000000002 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.009999999999998 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 75.219999999999999 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.109999999999999 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 71.099999999999994 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.414 HD12 ' N ' ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 74.400000000000006 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.400000000000006 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' CD ' ' H3 ' ' A' ' 1' ' ' MET . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.099999999999994 110.138 174.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.582 ' O ' HG23 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.099999999999994 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.403 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.219999999999999 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 74.409999999999997 112.498 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.582 HG23 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 70.109999999999999 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.209999999999994 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 75.010000000000005 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.019999999999996 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 71.120000000000005 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.459 HG21 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.420000000000002 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.459 ' N ' HG21 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 65.129999999999995 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.120000000000005 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.450000000000003 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.403 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 74.230000000000004 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.140000000000001 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.149999999999999 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.329999999999998 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 75.129999999999995 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.53 HD23 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.350000000000001 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.010000000000005 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 63.130000000000003 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.510000000000005 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.040000000000006 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.230000000000004 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.540000000000006 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.400000000000006 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.340000000000003 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 72.329999999999998 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.448 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 71.439999999999998 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 74.010000000000005 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.493 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.040000000000006 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.010000000000005 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.448 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.409999999999997 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 63.009999999999998 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.399999999999999 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.039999999999999 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.420000000000002 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -98.0 -170.99 2.07 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.040000000000006 111.198 175.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -109.36 27.63 9.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.929 0.395 . . . . 74.409999999999997 111.141 176.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 74' ' ' GLU . 34.1 t-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.665 -0.683 . . . . 74.25 111.907 -178.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.609 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.498 0.189 . . . . 72.129999999999995 111.164 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 -64.22 0.53 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.041 0.448 . . . . 53.43 111.517 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.37 76.96 1.98 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 121.161 -0.542 . . . . 62.420000000000002 112.573 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -116.48 90.18 29.6 Favored Pre-proline 0 CA--C 1.546 0.806 0 CA-C-O 120.688 0.28 . . . . 71.310000000000002 111.081 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.464 ' HB2' HG22 ' A' ' 7' ' ' THR . 56.4 Cg_endo -91.24 -5.44 4.1 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.825 2.35 . . . . 65.239999999999995 113.158 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.149999999999999 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.464 HG22 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 72.530000000000001 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.423 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.319999999999993 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.435 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.239999999999995 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.430000000000007 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.420000000000002 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.577 HG12 HD13 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.140000000000001 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.239999999999995 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.409999999999997 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.350000000000001 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.409999999999997 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.310000000000002 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.129999999999995 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 73.540000000000006 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.409 ' HB3' HE22 ' A' ' 57' ' ' GLN . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.420000000000002 112.296 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.349999999999994 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.329999999999998 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 74.430000000000007 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.577 HD13 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.530000000000001 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 64.040000000000006 112.763 -177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.010000000000005 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 73.200000000000003 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 61.119999999999997 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.240000000000002 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.509999999999998 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.503 ' O ' ' HB3' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.219999999999999 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.409999999999997 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.409999999999997 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.319999999999993 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.329999999999998 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.465 ' HB3' HG23 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 74.140000000000001 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.530000000000001 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.209999999999994 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.420000000000002 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.423 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 63.140000000000001 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.119999999999997 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.319999999999993 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.412 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.439999999999998 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.200000000000003 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.010000000000005 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.439999999999998 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.487 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 70.510000000000005 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.509999999999998 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 74.439999999999998 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.487 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 74.310000000000002 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.439999999999998 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.239999999999995 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.310000000000002 110.824 174.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.409 HE22 ' HB3' ' A' ' 21' ' ' PRO . 14.9 mm100 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.409999999999997 110.82 171.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.471 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.239999999999995 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 71.510000000000005 112.624 -177.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.664 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.310000000000002 111.672 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 64.400000000000006 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.466 HG22 HG12 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.230000000000004 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.664 HD22 ' HA ' ' A' ' 60' ' ' GLU . 11.1 p30 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.340000000000003 111.555 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.519999999999996 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.200000000000003 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.150000000000006 111.355 177.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 71.109999999999999 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.019999999999996 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.109999999999999 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.319999999999993 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.239999999999995 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 64.340000000000003 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.129999999999995 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.209999999999994 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.409999999999997 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.400000000000006 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -80.53 -29.41 37.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.010000000000005 110.921 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 66.77 -74.47 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.46 0.704 . . . . 72.030000000000001 112.511 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.78 -0.628 . . . . 74.450000000000003 111.665 -176.744 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.675 0.274 . . . . 75.349999999999994 111.272 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.84 107.45 2.55 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.055 0.391 . . . . 61.109999999999999 112.055 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.57 -48.58 0.61 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.873 -0.68 . . . . 75.129999999999995 113.889 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -94.97 120.49 64.36 Favored Pre-proline 0 CA--C 1.543 0.683 0 N-CA-C 112.324 0.49 . . . . 72.239999999999995 112.324 -175.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -89.67 11.15 2.93 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.965 2.443 . . . . 71.549999999999997 113.272 174.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.319999999999993 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.299999999999997 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.430000000000007 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.229999999999997 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.129999999999995 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.635 HG12 HD11 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.019999999999996 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.019999999999996 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.240000000000002 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 73.200000000000003 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.436 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 72.209999999999994 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.099999999999994 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.340000000000003 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.120000000000005 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.120000000000005 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.219999999999999 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 64.040000000000006 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.349999999999994 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.350000000000001 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.635 HD11 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.525 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.200000000000003 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.510000000000005 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.439999999999998 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 74.230000000000004 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.129999999999995 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.140000000000001 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.229999999999997 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.409999999999997 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.530000000000001 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.540000000000006 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 73.310000000000002 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.420000000000002 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.601 ' HB2' HD12 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.099999999999994 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.577 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.229999999999997 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.577 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.420000000000002 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.589 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.510000000000005 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.120000000000005 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.601 HD12 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.409999999999997 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.420000000000002 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.020000000000003 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.310000000000002 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.541 HG12 HG22 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.510000000000005 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.200000000000003 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.299999999999997 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.239999999999995 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 74.109999999999999 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 50.130000000000003 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.520000000000003 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.437 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.349999999999994 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.239999999999995 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.401 HD21 HD22 ' A' ' 25' ' ' LEU . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.020000000000003 110.628 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.040000000000006 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.230000000000004 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 72.349999999999994 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.541 HG22 HG12 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 75.549999999999997 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.310000000000002 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.319999999999993 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.540000000000006 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 73.0 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.030000000000001 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.209999999999994 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.030000000000001 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.589 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.219999999999999 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.310000000000002 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.230000000000004 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.109999999999999 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.430000000000007 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.299999999999997 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.200000000000003 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.319999999999993 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -165.52 -65.01 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.430000000000007 110.555 175.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -176.51 102.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.818 -0.628 . . . . 74.540000000000006 109.958 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 . . . . . 0 C--O 1.255 1.374 0 CA-C-N 116.056 -0.52 . . . . 72.239999999999995 111.094 -173.667 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.714 0.292 . . . . 75.510000000000005 111.128 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.43 -172.5 0.38 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.91 0.386 . . . . 61.219999999999999 111.203 -178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.411 ' O ' ' HD3' ' A' ' 5' ' ' PRO . . . 92.54 -63.1 2.31 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.312 -0.47 . . . . 65.340000000000003 114.101 175.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.55 113.07 8.51 Favored Pre-proline 0 CA--C 1.545 0.77 0 N-CA-C 113.622 0.971 . . . . 74.510000000000005 113.622 -173.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' A' ' 3' ' ' GLY . 92.0 Cg_endo -102.51 10.15 0.4 Allowed 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 123.669 2.913 . . . . 74.349999999999994 112.435 169.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.606 ' HE1' ' HA ' ' A' ' 6' ' ' MET . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.209999999999994 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 74.120000000000005 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.420000000000002 111.655 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.59 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.319999999999993 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.439999999999998 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.319999999999993 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.553 HG13 ' HB3' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.230000000000004 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.200000000000003 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.219999999999999 112.893 176.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.400000000000006 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.437 ' HB2' ' HB2' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 64.5 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 75.319999999999993 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.239999999999995 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.420000000000002 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.049999999999997 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.510000000000005 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.420000000000002 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.340000000000003 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.479 HD23 HD23 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 65.510000000000005 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.553 ' HB3' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 39.149999999999999 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.210000000000001 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.540000000000006 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.400000000000006 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.437 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.430000000000007 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.409999999999997 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.340000000000003 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.129999999999995 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.310000000000002 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 74.439999999999998 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.039999999999999 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.402 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.450000000000003 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.340000000000003 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.488 ' HB3' HD12 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.510000000000005 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.209999999999994 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.422 ' O ' HG21 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.549999999999997 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 74.120000000000005 112.088 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.340000000000003 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.422 HG21 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 74.140000000000001 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.488 HD12 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.329999999999998 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 73.049999999999997 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.140000000000001 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.712 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.099999999999994 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.150000000000006 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.239999999999995 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.109999999999999 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.140000000000001 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.240000000000002 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.450000000000003 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.530000000000001 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.479 HD23 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.130000000000003 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.120000000000005 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.420000000000002 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.229999999999997 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.712 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.230000000000004 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 73.140000000000001 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.437 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.040000000000006 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.030000000000001 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 73.409999999999997 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.439999999999998 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.495 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.349999999999994 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 71.209999999999994 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.510000000000005 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.240000000000002 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.495 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 75.150000000000006 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.129999999999995 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.239999999999995 111.694 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.209999999999994 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.540000000000006 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.349999999999994 110.507 174.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -88.63 90.56 8.45 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.140000000000001 110.456 173.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -65.61 -16.82 64.09 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.228 0.537 . . . . 75.349999999999994 110.937 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.494 -0.765 . . . . 74.549999999999997 110.592 175.632 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.8 tpp . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.913 0.387 . . . . 74.129999999999995 111.511 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.41 -173.7 3.92 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.189 0.519 . . . . 53.200000000000003 111.562 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -141.29 152.55 23.38 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 121.192 -0.528 . . . . 45.450000000000003 112.466 178.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -96.06 100.95 7.36 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-O 120.961 0.41 . . . . 74.409999999999997 111.53 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HB2' HG22 ' A' ' 7' ' ' THR . 74.0 Cg_endo -76.96 -26.83 7.5 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.282 1.988 . . . . 74.230000000000004 112.75 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.430000000000007 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.43 HG22 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.099999999999994 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.448 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 74.019999999999996 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.430000000000007 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.409999999999997 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.529 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.329999999999998 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.686 HG13 ' HB1' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.219999999999999 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 71.430000000000007 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.539999999999999 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 72.209999999999994 111.023 175.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.209999999999994 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.150000000000006 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.530000000000001 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.229999999999997 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.219999999999999 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.120000000000005 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HB3' HD13 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.329999999999998 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 71.219999999999999 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 74.340000000000003 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.686 ' HB1' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.219999999999999 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.439999999999998 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.129999999999995 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 41.439999999999998 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 74.420000000000002 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.329999999999998 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.209999999999994 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.536 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.340000000000003 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.439999999999998 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.536 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.229999999999997 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.010000000000005 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.464 HD23 ' O ' ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 73.230000000000004 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.019999999999996 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.409999999999997 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.040000000000006 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.659 ' HB3' HD13 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.109999999999999 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.040000000000006 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 74.25 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.299999999999997 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.420000000000002 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.140000000000001 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 72.439999999999998 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.534 HG12 HG22 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 74.140000000000001 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.099999999999994 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.120000000000005 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.219999999999999 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.109999999999999 112.901 -172.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 73.519999999999996 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.406 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.140000000000001 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.409999999999997 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.512 ' NE2' ' H ' ' A' ' 57' ' ' GLN . 2.1 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.530000000000001 111.375 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.109999999999999 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.340000000000003 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.522 ' HA ' HD22 ' A' ' 63' ' ' ASN . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.240000000000002 112.448 -173.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.099999999999994 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.534 HG22 HG12 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.522 HD22 ' HA ' ' A' ' 60' ' ' GLU . 9.6 p30 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.210000000000001 111.609 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.420000000000002 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.540000000000006 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.659 HD13 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.340000000000003 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 72.430000000000007 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 51.030000000000001 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.529 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.409999999999997 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.340000000000003 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.230000000000004 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.120000000000005 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.030000000000001 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.409999999999997 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.239999999999995 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.230000000000004 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 46.64 113.52 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.310000000000002 114.829 170.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -167.24 -33.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.812 -0.631 . . . . 55.100000000000001 110.89 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.402 -0.809 . . . . 70.25 110.89 176.589 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.5 ttm . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.42 0.152 . . . . 74.430000000000007 110.965 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 175.75 175.43 0.26 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.77 0.428 . . . . 72.209999999999994 111.02 -177.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.41 62.82 3.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 121.288 -0.482 . . . . 40.119999999999997 112.668 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.9 t0 55.13 90.99 0.08 OUTLIER Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 123.747 0.819 . . . . 72.219999999999999 112.229 -176.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -92.87 3.53 3.5 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.987 2.458 . . . . 74.030000000000001 113.321 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.310000000000002 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 65.239999999999995 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.477 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.349999999999994 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 73.319999999999993 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 61.520000000000003 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.513 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.540000000000006 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.671 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 37.200000000000003 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.109999999999999 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.519999999999996 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.340000000000003 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 61.409999999999997 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.329999999999998 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.409999999999997 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.039999999999999 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 72.120000000000005 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.469 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.510000000000005 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.329999999999998 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.430000000000007 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.671 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.040000000000006 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.100000000000001 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.230000000000004 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.477 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 75.010000000000005 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.409999999999997 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.230000000000004 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.200000000000003 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.299999999999997 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.319999999999993 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.129999999999995 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.519999999999996 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.446 HD12 ' HH ' ' A' ' 48' ' ' TYR . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.120000000000005 111.705 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.119999999999997 112.927 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.040000000000006 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.120000000000005 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.441 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.219999999999999 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.450000000000003 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.049999999999997 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.239999999999995 111.214 179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.475 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.230000000000004 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.613 ' HA ' ' HE3' ' A' ' 50' ' ' MET . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.129999999999995 111.342 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.446 ' HH ' HD12 ' A' ' 38' ' ' LEU . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 72.049999999999997 112.433 -178.11 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.621 HG12 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.219999999999999 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.613 ' HE3' ' HA ' ' A' ' 47' ' ' ALA . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 74.019999999999996 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 75.25 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.329999999999998 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 75.310000000000002 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.109999999999999 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 71.329999999999998 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.420000000000002 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.549999999999997 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 71.120000000000005 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.634 ' HA ' HD22 ' A' ' 63' ' ' ASN . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.319999999999993 111.598 -176.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 72.140000000000001 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.621 HG21 HG12 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 75.230000000000004 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.634 HD22 ' HA ' ' A' ' 60' ' ' GLU . 9.4 p30 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.200000000000003 110.848 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.099999999999994 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.441 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.209999999999994 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 74.239999999999995 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.540000000000006 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 75.340000000000003 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.576 ' HE3' ' HA ' ' A' ' 70' ' ' MET . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.329999999999998 111.949 -176.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.540000000000006 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.420000000000002 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.140000000000001 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.049999999999997 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.420000000000002 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.130000000000003 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.439999999999998 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -74.13 96.9 2.81 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 74.530000000000001 109.94 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -56.16 -23.13 33.03 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.669 0.618 . . . . 73.430000000000007 112.669 -173.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.475 -0.774 . . . . 73.409999999999997 110.96 -176.727 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 CA-C-O 120.812 0.255 . . . . 72.51 112.29 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 64.33 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 61.44 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.14 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 61.22 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.24 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 52.4 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.23 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.14 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.41 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.51 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' ' HB3' ' A' ' 26' ' ' ALA . 25.1 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 53.14 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.4 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.03 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.33 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.22 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.12 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 73.32 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.12 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 51.23 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.43 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 40.53 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.44 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.504 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 10.8 t-80 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.15 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 71.34 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.14 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.21 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.31 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.55 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.31 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.21 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.03 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.32 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.03 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.15 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.1 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.11 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.43 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 61.22 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.13 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HG2' ' SD ' ' A' ' 50' ' ' MET . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 61.15 110.851 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 61.41 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.784 HG21 HG21 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.33 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.71 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.4 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.24 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.51 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.41 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.11 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 72.12 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.21 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.55 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.41 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.71 HG23 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.01 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.44 111.823 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.11 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.784 HG21 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.43 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.01 111.455 -176.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.53 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.55 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.41 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.42 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.23 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.34 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.14 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.34 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.32 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.14 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.41 112.39 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 71.12 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 64.21 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 . . . . . 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 73.03 109.866 174.38 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.544 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 N-CA-C 113.701 0.616 . . . . 55.34 113.701 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.14 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.52 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 73.21 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.43 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.31 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.599 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.14 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.03 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.33 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.14 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.12 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.13 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.12 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 70.24 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.15 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.24 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.34 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.22 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.53 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.514 HD12 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.11 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.599 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.13 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.2 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.33 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.03 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.01 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.23 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.23 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.12 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.44 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 64.41 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.35 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 63.13 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.11 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.13 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.34 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.53 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.45 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.01 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.01 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 71.14 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 65.0 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.45 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.2 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 73.0 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.31 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.01 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.21 112.106 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 73.42 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.05 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.32 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.41 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.41 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.12 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.24 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.31 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.12 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.12 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.3 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.45 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.31 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.02 111.267 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.51 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.21 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.41 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.03 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.55 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.03 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.11 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.54 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 61.3 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 72.35 113.305 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.726 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo . . . . . 0 CA--C 1.542 0.915 0 CA-C-O 121.023 0.343 . . . . 63.23 112.217 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.44 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.42 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.22 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.34 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 64.42 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.13 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.04 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.53 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.11 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.432 ' OE1' ' HB3' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.52 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.14 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.53 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.45 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.1 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.44 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.23 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.12 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.33 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.21 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.432 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.03 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.41 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.33 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.4 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.31 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.44 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.21 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 64.42 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.43 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.497 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.4 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.52 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.54 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.726 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.32 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.23 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.11 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.33 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.42 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.32 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 60.13 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.31 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.24 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.533 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 73.11 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.42 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.4 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.01 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.533 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.24 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.31 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.2 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.42 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.24 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 73.11 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.44 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.467 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.34 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.44 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.468 ' OG1' HG11 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.41 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.14 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.44 ' O ' HD23 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.22 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.15 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.4 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.31 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.15 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.45 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.34 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.415 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.997 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.43 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.44 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.14 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.21 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 . . . . . 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.45 110.901 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.598 ' HD2' HG23 ' A' ' 7' ' ' THR . 4.6 Cg_exo . . . . . 0 CA--C 1.547 1.141 0 N-CA-C 112.801 0.269 . . . . 74.22 112.801 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.44 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.53 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.51 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.603 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 73.43 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.35 111.767 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.22 112.124 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.636 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.02 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.11 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.14 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.01 111.438 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.21 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.44 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.4 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.469 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.51 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.14 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.33 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.42 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.24 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.33 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.54 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.13 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.45 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.53 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.12 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.13 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.23 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.04 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.34 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.34 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.12 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 71.13 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.44 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.1 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.679 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.35 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.679 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.43 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 52.21 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 64.4 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 63.51 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 46' ' ' ARG . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.12 111.509 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.05 112.015 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.43 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.442 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.24 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.11 111.915 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 70.3 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.23 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.14 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.34 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.24 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.2 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.44 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.3 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.42 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 63' ' ' ASN . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.3 112.657 -171.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 72.33 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.21 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 60' ' ' GLU . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.33 111.38 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.14 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.12 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 74.2 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.12 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.42 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 62.35 111.935 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.1 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.13 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.12 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.12 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.22 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 78' ' ' HIS . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.32 111.693 -177.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.42 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.13 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 75' ' ' HIS . 11.6 t60 . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.34 110.224 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.458 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo . . . . . 0 CA--C 1.539 0.747 0 N-CA-C 112.542 0.17 . . . . 51.45 112.542 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.33 112.685 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.14 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.33 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.606 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 62.54 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.21 111.489 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.404 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.03 111.997 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.532 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.34 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.31 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 73.21 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.21 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 64.51 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 54.12 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.51 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 73.54 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 63.22 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 54.41 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.11 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.15 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.532 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.23 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.43 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.41 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.33 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 55.4 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.42 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.04 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.544 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.2 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.4 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.544 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.54 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.51 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.2 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.21 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.13 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.14 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.581 ' O ' HG22 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.54 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.623 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 72.43 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.42 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.3 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.55 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.31 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.34 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.53 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 41.03 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.3 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.31 113.168 -176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 70.01 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.11 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.467 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 61.31 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.34 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 64.1 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.04 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.35 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 73.12 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 74.01 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.33 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 53.13 112.227 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 73.12 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.54 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.623 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.53 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.51 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.21 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.41 111.77 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.23 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.15 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 65.01 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 72.11 110.939 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.43 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 74.41 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 71.31 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.21 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.44 110.978 175.996 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.542 0.904 0 CA-C-O 120.961 0.317 . . . . 62.34 111.67 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.14 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.03 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.32 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.543 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.31 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.22 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.21 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.14 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.543 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.41 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.12 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 73.0 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.31 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.13 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.32 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.02 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.14 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.21 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.476 ' HB3' HD11 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 64.52 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.2 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.11 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 51.22 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.477 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.34 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.24 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 64.11 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.4 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 31.45 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.33 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 71.13 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.03 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.45 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.42 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.13 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 39' ' ' GLU . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.4 112.641 -176.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 53.22 111.743 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 37' ' ' ARG . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 63.12 113.159 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.04 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.31 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.44 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.456 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.11 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 53.5 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.01 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.11 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.33 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 54.22 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.4 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.12 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.35 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.12 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 71.13 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.4 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.54 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 54.23 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.01 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.583 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.51 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.12 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 71.25 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.42 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.03 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.32 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.51 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.33 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 54.33 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 41.15 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 63.3 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 62.23 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.34 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.04 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.04 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.53 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.32 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.51 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 73.5 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.44 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.43 110.737 175.022 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 CA--C 1.542 0.924 0 N-CA-C 113.261 0.447 . . . . 75.33 113.261 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.05 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 63.03 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 71.15 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 55.15 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.14 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.12 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.54 112.381 -174.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 65.43 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.31 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.23 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.668 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.34 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.33 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.23 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.23 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.11 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.34 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 44.15 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.13 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 74.24 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.288 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.468 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.43 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.668 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.35 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.45 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.491 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.12 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.12 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.12 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.11 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.34 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.42 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.53 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.11 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.46 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.52 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.34 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.52 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.45 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.22 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.14 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' OE1' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.01 112.421 -179.285 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.32 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.32 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.427 ' HB2' HG21 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.31 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.453 ' HA ' ' HE2' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.13 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.42 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.611 HG11 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 62.1 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.453 ' HE2' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.51 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.22 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.01 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.44 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.04 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 43.14 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 72.1 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.42 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.33 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.21 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.02 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.44 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.611 HG21 HG11 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.45 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.2 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.33 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG21 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.23 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.24 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.21 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.41 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.02 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.13 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.32 110.498 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 52.25 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.4 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 64.42 111.658 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.24 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 74.31 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.24 109.205 170.89 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 CA--C 1.546 1.12 0 N-CA-C 113.855 0.675 . . . . 74.22 113.855 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.42 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.34 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.34 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.2 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.23 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.3 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 72.04 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.11 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.13 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.13 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 1.2 tm0? -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.52 111.575 -177.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 64.14 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.42 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.55 113.587 -164.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 45.03 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.23 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 52.5 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 31.32 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.24 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.01 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 72.22 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.24 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.593 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.04 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.02 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.14 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.23 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.33 111.094 173.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.54 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 61.3 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 73.2 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.436 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.03 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 73.45 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.12 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.31 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.651 ' HB3' HD12 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.22 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.31 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.1 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.44 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.33 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.21 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.32 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.524 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.41 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.445 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.32 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 53.15 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 64.21 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.524 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.53 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.452 HG23 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.15 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.452 ' H ' HG23 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.21 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.44 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.44 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.55 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 71.41 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.03 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.31 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 54.43 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.45 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.651 HD12 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.41 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 72.42 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.32 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 53.21 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.456 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.12 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.31 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.33 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.53 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 61.22 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.11 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 64.53 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 . . . . . 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.2 112.476 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 CA--C 1.547 1.156 0 N-CA-C 113.847 0.672 . . . . 62.5 113.847 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.21 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.45 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.32 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 73.12 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.42 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.3 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.41 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.24 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.43 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.54 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.15 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.45 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.52 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.32 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.12 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.52 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.33 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.12 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.501 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.2 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.4 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.11 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.53 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.43 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 62.51 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.14 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.44 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.42 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.04 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.43 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.568 ' O ' HG22 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.14 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.53 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.1 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.34 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.44 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.31 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.33 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.34 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.45 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.585 HG11 HG21 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.44 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG2' HD13 ' A' ' 59' ' ' ILE . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.04 110.974 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.423 ' HB3' ' HA ' ' A' ' 48' ' ' TYR . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.14 111.87 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 42.24 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.02 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.13 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.2 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.44 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.13 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.501 HD22 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.12 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.4 HD13 ' HG2' ' A' ' 50' ' ' MET . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.44 112.313 -177.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.4 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.42 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.585 HG21 HG11 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 61.35 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.2 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 72.22 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.51 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.34 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.11 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.23 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.32 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.14 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.02 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.22 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.04 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.22 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 63.43 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.15 112.406 178.411 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo . . . . . 0 CA--C 1.539 0.763 0 N-CA-C 113.199 0.423 . . . . 74.14 113.199 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.24 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.532 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 64.43 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.03 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.42 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.714 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.44 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.24 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.14 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' HG2' ' HB2' ' A' ' 27' ' ' GLU . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.12 111.207 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.4 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.02 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.12 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 63.42 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.31 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.54 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.02 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.33 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.24 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.714 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.3 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.1 111.529 -177.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.34 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.23 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.24 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.15 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.35 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.02 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.31 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 35' ' ' PHE . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.43 112.578 175.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.4 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.11 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.34 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.13 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.13 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.23 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.34 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.54 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.34 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.22 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.53 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.42 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.21 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.11 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.02 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 54.5 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.41 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.21 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.41 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.3 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 73.24 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.11 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.469 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.14 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.52 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.14 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.51 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 65.15 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 60.35 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.3 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.532 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 72.23 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 55.34 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 23.42 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.01 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.04 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.35 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 71.34 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.21 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.55 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.55 111.701 179.152 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 CA-C-O 120.97 0.321 . . . . 61.44 112.702 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.44 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.35 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 62.13 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.412 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.23 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 72.25 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.51 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.2 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 64.42 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.42 111.519 -177.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.13 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.41 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.35 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 34.4 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HD1' HG23 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 53.24 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 21.33 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.42 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 54.34 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 64.01 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 71.21 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 62.43 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 55.01 111.131 176.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.32 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.42 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.42 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.43 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.21 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.05 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.03 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.31 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.35 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.52 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.565 ' O ' HG22 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.34 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.551 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 73.51 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.33 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 51.42 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.758 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.14 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.12 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.51 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.42 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.02 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.654 ' HG2' HG23 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.43 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.34 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.04 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.52 112.164 -174.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.32 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.43 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.14 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.22 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.1 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.04 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.53 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.55 HG23 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 54.34 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.65 HG21 HG21 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.43 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 65.14 112.025 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.54 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.35 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.44 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 74.32 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.42 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.551 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.31 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.02 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.22 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.24 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.35 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.02 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.54 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.44 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.13 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 m80 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.44 110.759 172.972 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.543 0.944 0 N-CA-C 113.174 0.413 . . . . 73.13 113.174 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.31 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.53 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HZ ' HD11 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.11 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.547 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 70.14 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.34 111.662 -177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.33 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.662 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.41 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.04 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.14 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.22 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.24 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.13 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.23 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 71.2 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 74.13 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.41 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.52 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.11 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.05 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.42 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.662 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.03 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.45 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 70.41 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.41 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.4 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.22 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.13 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.12 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 61.34 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.34 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.45 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.2 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HA ' HD11 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.41 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.42 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.23 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.31 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.56 HG22 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.4 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.44 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.02 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.34 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 62.42 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 52.22 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 33.42 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.13 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 45.43 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 62.54 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.32 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.47 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.13 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.53 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.01 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.05 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.22 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.54 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.55 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.04 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.22 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.14 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.44 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.14 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.21 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.34 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.45 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.12 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.41 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.13 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.11 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 71.3 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.24 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.11 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 64.34 111.257 175.226 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo . . . . . 0 CA--C 1.547 1.157 0 N-CA-C 114.67 0.988 . . . . 41.41 114.67 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 73.21 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.515 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 73.44 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.32 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.15 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.51 111.454 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.4 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.14 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.42 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.41 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.44 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.52 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.01 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.31 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.52 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.23 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.522 ' HB3' HD11 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.14 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.35 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.43 111.889 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.54 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.43 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.515 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.34 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.32 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.45 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.45 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 60.44 110.249 172.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.11 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.434 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 73.3 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.24 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.434 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.1 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 38' ' ' LEU . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.4 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.53 111.939 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.41 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.51 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB3' HG23 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.02 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.22 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.22 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' HD11 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.33 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.44 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.2 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.32 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.48 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.12 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.52 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.1 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.33 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.22 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.12 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.54 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 61.21 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.11 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.585 HG22 ' ND2' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.44 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.23 112.182 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.54 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.41 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.585 ' ND2' HG22 ' A' ' 59' ' ' ILE . 27.1 p30 -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.32 112.729 -173.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.11 110.724 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.03 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.43 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.11 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.33 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 63.13 111.536 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.21 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 43.2 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.42 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 53.33 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.24 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.1 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.34 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.32 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 . . . . . 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.13 111.801 -178.79 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-O 120.79 0.246 . . . . 73.22 112.546 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.42 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.24 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.2 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 33.42 110.91 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.14 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.05 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.56 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.42 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.24 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.23 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.443 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.32 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.41 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.4 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 71.04 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 72.15 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.23 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.443 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 71.44 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.01 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.54 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.34 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.51 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 51.35 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.43 111.784 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.43 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.14 110.753 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.03 111.519 178.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 51.04 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.13 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.34 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.12 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.24 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.03 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 71.0 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.14 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.44 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 73.32 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.43 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.13 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.32 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.33 111.92 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.51 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.22 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.539 HG11 HG21 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.11 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.45 111.269 176.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.14 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.45 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.31 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.11 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.42 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.51 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.15 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.34 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 70.13 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.1 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.413 HG23 ' HD2' ' A' ' 22' ' ' PHE . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.14 111.147 174.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.539 HG21 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 71.23 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.31 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 64' ' ' ARG . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.24 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.01 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.22 111.179 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 72.11 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 35.53 111.463 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 72.4 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.22 111.369 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 72.04 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.21 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.24 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.14 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 71.41 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.52 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.4 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.41 110.617 -179.926 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 N-CA-C 113.368 0.488 . . . . 35.13 113.368 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.24 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.23 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.31 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.02 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.42 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.691 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.32 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.586 ' HG2' ' O ' ' A' ' 9' ' ' TYR . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.54 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.03 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.03 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.44 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.24 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.2 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.22 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 32.35 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.42 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.691 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.52 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.53 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.15 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 61.22 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.23 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.4 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.42 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.01 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 63.4 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.11 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 62.05 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 73.02 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.4 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.1 110.138 174.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.594 ' O ' HG22 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.1 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.405 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.22 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 73.42 112.498 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 61.2 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.21 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 74.22 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.02 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 65.32 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.42 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.482 ' N ' HG23 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 63.41 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.12 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.45 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 71.13 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.14 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.15 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.33 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 73.52 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.35 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.01 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 61.41 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.51 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.04 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.23 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.54 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.4 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.34 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 64.02 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 53.44 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 65.52 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.491 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.04 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.01 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.41 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 51.34 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.4 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.04 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.42 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.44 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.04 111.198 175.586 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HB2' HG23 ' A' ' 7' ' ' THR . 56.4 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 N-CA-C 113.158 0.407 . . . . 65.24 113.158 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.15 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 70.21 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.438 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.32 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.24 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.43 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.42 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.562 HG12 HD12 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.14 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.24 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.41 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.35 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.41 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.31 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.13 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.42 112.296 173.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.35 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.33 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 63.23 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.562 HD12 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.53 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 50.42 112.763 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.01 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 72.11 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 44.22 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.24 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.51 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.22 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.41 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.41 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.32 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.33 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.479 ' HB3' HG21 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 71.33 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.33 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.21 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.42 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.438 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 60.43 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.12 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.32 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.44 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.2 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.01 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.24 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.483 HG11 HG21 ' A' ' 62' ' ' THR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 61.01 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.51 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 72.22 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 55.14 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.44 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.24 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 59' ' ' ILE . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.31 110.824 174.02 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.41 110.82 171.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.24 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 56' ' ' HIS . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 62.52 112.624 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.31 111.672 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 62.31 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.483 HG21 HG11 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.23 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.34 111.555 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.52 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.2 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 62' ' ' THR . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.15 111.355 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 63.14 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.02 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.11 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.32 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.24 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 63.15 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.13 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.21 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.41 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.4 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.01 110.921 176.239 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 CA--C 1.545 1.07 0 N-CA-C 113.272 0.451 . . . . 71.55 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.32 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.3 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.43 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.23 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.13 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.638 HG12 HD12 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.02 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.02 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.24 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 63.43 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 70.21 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.1 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.34 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.12 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.22 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 60.12 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.35 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.35 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.638 HD12 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.41 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.2 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.51 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 61.41 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.13 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.14 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.23 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.41 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.53 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 63.32 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.42 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.629 ' HB2' HD11 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.1 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.598 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.23 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.598 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.42 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.587 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.51 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.12 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.629 HD11 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.41 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.42 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.02 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.31 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.574 HG11 HG21 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.51 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.2 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.3 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.24 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 70.31 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 45.55 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.52 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.35 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.24 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.02 110.628 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.04 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.23 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 53.54 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.574 HG21 HG11 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 64.24 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.31 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.32 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.3 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 72.22 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.03 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.21 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.03 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.587 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.22 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.31 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.23 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.11 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.43 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.3 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.2 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.32 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.43 110.555 175.924 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo . . . . . 0 CA--C 1.545 1.065 0 CA-C-O 120.69 0.204 . . . . 74.35 112.435 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.596 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.21 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 70.22 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.409 ' HA ' ' CE1' ' A' ' 42' ' ' HIS . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.42 111.655 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.596 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.32 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.44 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.32 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.23 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.2 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' ND2' ' A' ' 17' ' ' ASN . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.22 112.893 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.4 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 60.3 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.403 ' ND2' ' HA2' ' A' ' 14' ' ' GLY . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 74.31 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.24 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.42 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.05 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.51 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.42 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.34 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 61.41 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.591 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 32.35 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.21 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.54 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.4 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.43 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.41 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.13 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.31 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 64.0 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.04 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.45 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.34 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.51 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.21 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.55 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' A' ' 8' ' ' PHE . 73.9 m-70 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 73.02 112.088 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.34 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 72.01 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.33 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 71.13 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.14 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.734 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.1 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.15 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.24 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.11 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.14 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.24 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.0 t60 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.45 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.03 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.13 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.12 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.42 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.23 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.23 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 64.25 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.04 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.03 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 65.3 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.44 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.35 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 63.52 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.51 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.24 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 73.04 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.13 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.24 111.694 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.21 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.54 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.35 110.507 174.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.4 m80 . . . . . 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.456 173.191 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HB2' HG23 ' A' ' 7' ' ' THR . 74.0 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 112.75 0.25 . . . . 74.23 112.75 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.43 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.1 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 52.23 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.43 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.41 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.548 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.33 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.759 HG13 ' HB2' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.22 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 63.32 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.54 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 71.54 111.023 175.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.21 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.15 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.53 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.23 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.15 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.12 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.33 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 15' ' ' PHE . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 53.23 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 73.53 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.22 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.56 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.44 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.13 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 34.5 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 45.11 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.33 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.21 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.551 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.34 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.44 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.23 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.01 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.35 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 71.24 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.02 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.41 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.04 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.691 ' HB3' HD12 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.11 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.04 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 63.44 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.3 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.42 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.14 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 62.05 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.504 HG11 HG21 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 73.24 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.1 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.12 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.22 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' A' ' 58' ' ' LEU . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.11 112.901 -172.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 53.24 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.14 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.41 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.53 111.375 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.11 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.34 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.24 112.448 -173.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.1 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.504 HG21 HG11 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.21 111.609 -175.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.54 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.691 HD12 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.34 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 71.42 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 42.23 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.41 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.34 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.23 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.12 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.03 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.41 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.24 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.23 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.31 114.829 170.72 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 CA--C 1.541 0.853 0 N-CA-C 113.321 0.47 . . . . 44.03 113.321 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.31 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 61.53 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.481 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.35 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 71.44 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 53.43 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.518 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.54 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.704 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 62.32 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 35.43 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.11 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.475 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.52 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.34 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 60.22 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.33 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.41 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.04 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 71.54 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.51 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.33 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.43 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.04 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.1 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.23 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.481 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 71.25 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.23 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.23 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.2 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.3 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.32 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.13 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.52 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.12 111.705 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG3' HD11 ' A' ' 45' ' ' ILE . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.12 112.927 -173.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.04 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.12 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.22 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.45 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.05 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 39' ' ' GLU . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.24 111.214 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.23 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.13 111.342 176.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 71.3 112.433 -178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.22 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.41 ' HB2' ' HE2' ' A' ' 50' ' ' MET . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 71.13 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 71.14 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.33 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 74.33 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.11 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 70.43 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.42 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.55 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 52.54 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.32 111.598 -176.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 65.23 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.674 HG21 HG11 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 73.03 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.2 110.848 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.42 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.1 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.21 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 72.44 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.54 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 65.43 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.33 111.949 -176.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.54 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.42 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.14 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.05 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.42 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.13 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.44 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 73.43 109.94 174.805 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.9 mmm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.686 0.279 . . . . 71.23 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.0 127.6 32.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.995 0.426 . . . . 71.15 111.896 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.02 82.35 0.35 Allowed Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.196 -0.456 . . . . 53.2 112.042 177.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.87 98.17 32.62 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 112.393 0.516 . . . . 73.45 112.393 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.43 -20.32 5.94 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.323 2.016 . . . . 72.51 112.29 173.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 64.33 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 61.44 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.14 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 61.22 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.24 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 52.4 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.23 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.14 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.41 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.51 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' ' HB3' ' A' ' 26' ' ' ALA . 25.1 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 53.14 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.4 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.03 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.33 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.22 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.12 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 73.32 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.12 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 51.23 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.43 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 40.53 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.44 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.504 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 10.8 t-80 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.15 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 71.34 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.14 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.21 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.31 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.55 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.31 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.21 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.03 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.32 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.03 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.15 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.1 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.11 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.43 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 61.22 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.13 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HG2' ' SD ' ' A' ' 50' ' ' MET . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 61.15 110.851 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 61.41 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.784 HG21 HG21 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.33 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.71 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.4 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.24 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.51 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.41 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.11 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 72.12 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.21 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.55 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.41 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.71 HG23 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.01 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.44 111.823 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.11 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.784 HG21 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.43 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.01 111.455 -176.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.53 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.55 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.41 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.42 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.23 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.34 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.14 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.34 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.32 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.14 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' A' ' 79' ' ' HIS . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.41 112.39 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 71.12 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.0 m80 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 64.21 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -134.02 101.82 5.19 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 73.03 109.866 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 16.4 t-80 -132.54 86.86 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.179 0.437 . . . . 74.34 112.179 -176.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.5 -0.762 . . . . 64.51 112.534 178.559 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.433 ' SD ' ' C ' ' A' ' 1' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.762 0.315 . . . . 71.11 110.535 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.04 59.74 3.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.491 0.662 . . . . 61.22 110.197 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.87 172.06 20.88 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.341 -0.845 . . . . 50.12 111.162 -173.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.29 83.33 0.23 Allowed Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 117.113 0.457 . . . . 71.21 110.751 -176.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.544 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo -58.77 -22.64 62.66 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.668 2.245 . . . . 55.34 113.701 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.14 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.52 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 73.21 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.43 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.31 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.599 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.14 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.03 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.33 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.14 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.12 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.13 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.12 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 70.24 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.15 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.24 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.34 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.22 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.53 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.514 HD12 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.11 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.599 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.13 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.2 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.33 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.03 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.01 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.23 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.23 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.12 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.44 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 64.41 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.35 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 63.13 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.11 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.13 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.34 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.53 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.45 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.01 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.01 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 71.14 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 65.0 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.45 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.2 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 73.0 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.31 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.01 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.21 112.106 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 73.42 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.05 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.32 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.41 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.41 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.12 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.24 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.31 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.12 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.12 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.3 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.45 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.31 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.02 111.267 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.51 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.21 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.41 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.03 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.55 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.03 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.11 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.54 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 61.3 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 65.13 96.5 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 72.35 113.305 173.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -156.02 127.06 6.99 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.262 -0.426 . . . . 63.5 111.475 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.626 -0.702 . . . . 74.34 110.711 175.478 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.484 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.7 0.286 . . . . 74.24 111.389 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.25 86.92 3.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.197 0.523 . . . . 74.12 111.458 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 140.16 -164.7 26.15 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 116.045 -0.525 . . . . 71.22 112.271 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -148.78 99.37 3.54 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 117.387 0.594 . . . . 73.22 112.193 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.726 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo -79.17 -7.14 15.14 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.126 2.551 . . . . 63.23 112.217 171.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.44 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.42 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.22 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.34 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 64.42 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.13 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.04 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.53 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.11 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.432 ' OE1' ' HB3' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.52 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.14 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.53 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.45 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.1 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.44 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.23 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.12 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.33 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.21 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.432 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.03 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.41 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.33 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.4 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.31 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.44 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.21 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 64.42 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.43 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.497 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.4 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.52 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.54 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.726 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.32 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.23 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.11 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.33 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.42 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.32 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 60.13 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.31 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.24 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.533 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 73.11 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.42 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.4 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.01 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.24 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.31 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.2 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.42 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.24 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 73.11 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.44 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.467 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.34 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.44 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.468 ' OG1' HG11 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.41 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.14 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.44 ' O ' HD23 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.22 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.15 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.4 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.31 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.15 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.45 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.34 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.415 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.997 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.43 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.44 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.14 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.21 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.44 111.61 2.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.45 110.901 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 58.64 62.52 1.92 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 121.262 0.553 . . . . 71.45 110.711 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.407 -0.806 . . . . 55.03 111.333 -179.716 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.587 0.232 . . . . 62.22 111.081 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.41 150.17 21.38 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.806 0.336 . . . . 42.41 111.252 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.45 -175.07 34.2 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 121.055 -0.593 . . . . 74.52 114.295 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.8 t70 62.02 111.08 0.03 OUTLIER Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.955 0.902 . . . . 71.52 113.241 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.598 ' HD2' HG23 ' A' ' 7' ' ' THR . 4.6 Cg_exo -79.41 38.66 0.75 Allowed 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.101 2.534 . . . . 74.22 112.801 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.44 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.53 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.51 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.603 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 73.43 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.35 111.767 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.22 112.124 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.636 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.02 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.11 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.14 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.01 111.438 177.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.21 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.44 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.4 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.469 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.51 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.14 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.33 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.42 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.24 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.33 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.54 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.13 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.45 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.53 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.12 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.13 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.23 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.04 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.34 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.34 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.12 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 71.13 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.44 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.1 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.679 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.35 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.679 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.43 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 52.21 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 64.4 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 63.51 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 46' ' ' ARG . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.12 111.509 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.05 112.015 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.43 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.442 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.24 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.11 111.915 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 70.3 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.23 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.14 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.34 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.24 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.2 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.44 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.3 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.42 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 63' ' ' ASN . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.3 112.657 -171.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 72.33 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.21 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 60' ' ' GLU . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.33 111.38 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.14 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.12 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 74.2 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.12 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.42 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 62.35 111.935 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.1 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.13 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.12 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.12 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.22 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 78' ' ' HIS . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.32 111.693 -177.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.42 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.13 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 75' ' ' HIS . 11.6 t60 -85.59 77.1 9.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.34 110.224 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -60.78 -54.19 48.21 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.088 0.403 . . . . 44.24 112.088 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.615 -0.707 . . . . 71.31 111.389 178.685 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.8 mmm . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.999 0.428 . . . . 62.0 111.0 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.8 87.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.247 -0.433 . . . . 74.03 110.732 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.26 -59.99 3.18 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.149 -0.548 . . . . 70.53 112.57 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 53.81 75.61 0.61 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.259 0.624 . . . . 74.51 112.292 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.458 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo -65.03 -51.77 1.47 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.466 2.111 . . . . 51.45 112.542 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.33 112.685 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.14 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.33 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.606 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 62.54 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.21 111.489 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.404 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.03 111.997 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.532 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.34 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.31 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 73.21 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.21 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 64.51 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 54.12 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.51 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 73.54 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 63.22 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 54.41 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.11 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.15 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.532 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.23 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.43 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.41 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.33 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 55.4 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.42 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.04 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.544 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.2 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.4 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.544 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.54 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.51 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.2 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.21 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.13 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.14 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.581 ' O ' HG22 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.54 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.623 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 72.43 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.42 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.3 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.55 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.31 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.34 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.53 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 41.03 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.3 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.31 113.168 -176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 70.01 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.11 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.467 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 61.31 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.34 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 64.1 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.04 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.35 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 73.12 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 74.01 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.33 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 53.13 112.227 -173.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 73.12 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.54 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.623 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.53 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.51 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.21 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.41 111.77 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.23 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.15 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 65.01 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 72.11 110.939 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.43 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 74.41 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 71.31 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.21 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -78.69 -25.84 44.83 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.44 110.978 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.5 m80 61.99 -178.38 0.13 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.891 -0.595 . . . . 72.1 112.602 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.342 -0.837 . . . . 75.22 111.414 176.983 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.781 0.324 . . . . 72.11 111.66 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.43 80.18 1.04 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.336 0.589 . . . . 72.23 111.81 -178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.477 ' HA3' ' HG ' ' A' ' 38' ' ' LEU . . . -100.94 37.5 3.57 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-N 116.085 -0.507 . . . . 54.33 112.809 178.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.466 ' N ' ' CD ' ' A' ' 5' ' ' PRO . 13.5 m-20 -128.29 33.05 0.23 Allowed Pre-proline 0 CA--C 1.553 1.081 0 N-CA-C 113.969 1.1 . . . . 75.43 113.969 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' CD ' ' N ' ' A' ' 4' ' ' ASP . 38.7 Cg_endo -66.27 -51.41 1.11 Allowed 'Trans proline' 0 C--N 1.363 1.332 0 CA-C-N 120.951 1.375 . . . . 62.34 111.67 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.14 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.03 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.32 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.543 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.31 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.22 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.21 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.14 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.543 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.41 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.12 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 73.0 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.31 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.13 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.32 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.02 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.14 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.21 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.476 ' HB3' HD11 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 64.52 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.2 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.11 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 51.22 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.477 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.34 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.24 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 64.11 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.4 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 31.45 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.33 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 71.13 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.03 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.45 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.42 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.13 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 39' ' ' GLU . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.4 112.641 -176.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.477 ' HG ' ' HA3' ' A' ' 3' ' ' GLY . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 53.22 111.743 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 37' ' ' ARG . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 63.12 113.159 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.04 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.31 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.44 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.456 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.11 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 53.5 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.01 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.11 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.33 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 54.22 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.4 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.12 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.35 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.12 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 71.13 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.4 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.54 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 54.23 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.01 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.583 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.51 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.12 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 71.25 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.42 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.03 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.32 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.51 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.33 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 54.33 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 41.15 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 63.3 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 62.23 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.34 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.04 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.04 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.53 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.32 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.51 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 73.5 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.44 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -94.27 -28.21 15.72 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.43 110.737 175.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -141.43 -168.17 2.58 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.79 0.436 . . . . 71.33 111.391 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.85 -0.595 . . . . 50.13 111.994 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.8 mpp? . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.518 0.199 . . . . 72.53 110.711 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.8 90.19 3.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 120.878 0.371 . . . . 64.51 111.821 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 66.66 -90.88 0.17 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.347 -0.454 . . . . 70.24 113.531 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -110.06 99.77 40.76 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-O 121.264 0.554 . . . . 74.54 111.745 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.55 -51.25 0.1 OUTLIER 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 122.525 2.15 . . . . 75.33 113.261 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.05 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 63.03 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 71.15 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 55.15 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.14 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.12 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.54 112.381 -174.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 65.43 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.31 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.23 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.668 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.34 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.33 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.23 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.23 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.11 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.34 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 44.15 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.13 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 74.24 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.288 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.468 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.43 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.668 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.35 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.45 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.491 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.12 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.12 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.12 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.11 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.34 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.42 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.53 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.11 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.46 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.52 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.34 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.52 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.45 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.22 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.14 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' OE1' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.01 112.421 -179.285 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.32 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.32 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.427 ' HB2' HG21 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.31 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' HA ' ' HE2' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.13 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.42 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.611 HG11 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 62.1 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.453 ' HE2' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.51 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.22 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.01 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.44 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.04 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 43.14 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 72.1 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.42 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.33 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.21 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.02 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.44 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.611 HG21 HG11 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.45 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.2 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.33 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG21 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.23 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.24 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.21 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.41 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.02 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.13 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.32 110.498 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 52.25 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.4 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 64.42 111.658 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.24 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 74.31 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -103.15 80.08 1.81 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.24 109.205 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -64.89 -49.2 71.41 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.116 -0.493 . . . . 74.33 111.15 -174.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-N 116.57 -0.287 . . . . 52.43 111.471 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.454 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.2 mpp? . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 120.754 0.311 . . . . 71.44 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.07 97.13 3.35 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.898 0.38 . . . . 74.43 111.77 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.81 40.98 2.25 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 121.315 -0.469 . . . . 73.44 112.532 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.469 ' HB3' ' HA ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -150.67 61.77 4.88 Favored Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 112.389 0.514 . . . . 74.24 112.389 -176.412 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -70.25 11.03 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 122.62 2.214 . . . . 74.22 113.855 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.42 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.34 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.34 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.2 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.23 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.3 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 72.04 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.11 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.13 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.13 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 1.2 tm0? -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.52 111.575 -177.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 64.14 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.42 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.55 113.587 -164.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 45.03 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.23 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 52.5 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 31.32 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.24 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.01 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 72.22 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-160 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.24 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.593 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.04 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.02 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.14 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.23 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.401 ' HE2' ' OD1' ' A' ' 4' ' ' ASP . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.33 111.094 173.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.54 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 61.3 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 73.2 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.469 ' HA ' ' HB3' ' A' ' 4' ' ' ASP . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.03 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 73.45 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.12 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.31 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.651 ' HB3' HD12 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.22 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.31 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.1 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.44 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.33 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.21 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.32 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.524 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.41 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.445 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.32 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 53.15 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 64.21 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.524 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.53 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.452 HG23 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.15 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.452 ' H ' HG23 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.21 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.44 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.44 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.55 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 71.41 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.03 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.31 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 54.43 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.45 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.651 HD12 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.41 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 72.42 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.32 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 53.21 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.456 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.12 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.31 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.33 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.53 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 61.22 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.11 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 64.53 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 70.56 -52.62 0.66 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.2 112.476 -175.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.18 107.49 1.58 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.326 0.491 . . . . 72.33 112.326 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 123.41 0.684 . . . . 74.32 112.775 177.391 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.427 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.6 mpp? . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.726 0.298 . . . . 72.24 111.226 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.98 148.19 42.32 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.892 0.377 . . . . 65.5 111.909 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.47 174.76 49.99 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 120.898 -0.668 . . . . 71.11 112.855 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 21.0 t70 70.06 116.38 0.03 OUTLIER Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 122.91 0.484 . . . . 73.31 111.736 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.7 Cg_endo -85.84 -68.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.194 2.596 . . . . 62.5 113.847 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.21 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.45 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.32 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 73.12 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.42 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.3 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.41 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.24 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.43 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.54 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.15 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.45 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.52 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.32 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.12 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.52 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.33 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.12 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.501 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.2 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.4 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.11 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.53 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.43 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 62.51 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.14 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.44 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.42 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.04 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.43 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.568 ' O ' HG22 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.14 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.53 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.1 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.34 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.44 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.31 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.33 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.34 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.45 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.585 HG11 HG21 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.44 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG2' HD13 ' A' ' 59' ' ' ILE . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.04 110.974 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.423 ' HB3' ' HA ' ' A' ' 48' ' ' TYR . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.14 111.87 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 42.24 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.02 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.13 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.2 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.44 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.13 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.501 HD22 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.12 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.4 HD13 ' HG2' ' A' ' 50' ' ' MET . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.44 112.313 -177.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.4 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.42 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.585 HG21 HG11 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 61.35 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.2 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 72.22 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.51 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.34 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.11 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.23 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.32 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.14 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.02 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.22 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.04 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.22 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 63.43 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -103.69 125.26 50.07 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.15 112.406 178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -102.19 -55.39 2.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.254 -1.017 . . . . 62.43 108.254 166.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 . . . . . 0 C--O 1.255 1.372 0 CA-C-N 114.722 -1.127 . . . . 70.34 109.815 170.506 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.388 0.137 . . . . 61.12 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.8 22.9 3.46 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.459 0.541 . . . . 63.05 112.459 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 113.74 -42.89 1.82 Allowed Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.43 -0.414 . . . . 74.44 112.82 -176.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.75 117.37 55.09 Favored Pre-proline 0 CA--C 1.543 0.709 0 O-C-N 122.619 -0.342 . . . . 73.04 111.0 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.34 -17.35 49.5 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.808 2.339 . . . . 74.14 113.199 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.24 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.532 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 64.43 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.03 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.42 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.714 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.44 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.24 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.14 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' HG2' ' HB2' ' A' ' 27' ' ' GLU . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.12 111.207 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.4 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.02 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.12 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 63.42 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.31 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.54 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.02 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.33 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.24 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.714 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.3 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.1 111.529 -177.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.34 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.23 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.24 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.15 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.35 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.02 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.31 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 35' ' ' PHE . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.43 112.578 175.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.4 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.11 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.34 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.13 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.13 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.23 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.34 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.54 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.34 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.22 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.53 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.42 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.21 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.11 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.02 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 54.5 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.41 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.21 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.41 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.3 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 73.24 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.11 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.469 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.14 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.52 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.14 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.51 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 65.15 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 60.35 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.3 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.532 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 72.23 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 55.34 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 23.42 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.01 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.04 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.35 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 71.34 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.21 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.55 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -123.31 99.87 6.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.55 111.701 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.26 126.92 34.65 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.498 -0.319 . . . . 74.33 110.415 172.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.491 -0.766 . . . . 71.45 111.953 -178.14 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.483 ' HG2' ' H ' ' A' ' 3' ' ' GLY . 26.9 ttt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 120.422 0.153 . . . . 74.32 110.763 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.89 -15.12 35.17 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.104 0.478 . . . . 42.3 111.764 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.483 ' H ' ' HG2' ' A' ' 1' ' ' MET . . . -101.67 -163.35 27.07 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.378 -0.439 . . . . 61.43 112.981 176.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -129.91 116.55 18.04 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.365 0.506 . . . . 63.34 112.365 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -101.68 9.37 0.49 Allowed 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 123.354 2.703 . . . . 61.44 112.702 168.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.44 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.35 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 62.13 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.412 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.23 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 72.25 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.51 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.2 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 64.42 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.42 111.519 -177.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.13 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.41 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.35 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 34.4 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HD1' HG23 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 53.24 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 21.33 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.42 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 54.34 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 64.01 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 71.21 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 62.43 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 55.01 111.131 176.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.32 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.42 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.42 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.43 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.21 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.05 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.03 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.31 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.35 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.52 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.565 ' O ' HG22 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.34 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.551 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 73.51 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.33 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 51.42 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.758 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.14 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.12 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.51 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.42 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.02 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.654 ' HG2' HG23 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.43 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.34 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.04 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.52 112.164 -174.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.32 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.43 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.14 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.22 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.1 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.04 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.53 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.55 HG23 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 54.34 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.65 HG21 HG21 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.43 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 65.14 112.025 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.54 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.35 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.44 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 74.32 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.42 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.551 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.31 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.02 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.22 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.24 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.35 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.02 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.54 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.44 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.13 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -118.71 171.36 8.25 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.44 110.759 172.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.8 m80 -145.83 173.61 11.97 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.975 0.417 . . . . 62.11 111.364 178.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.759 -0.639 . . . . 64.03 112.012 -179.232 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 120.772 0.32 . . . . 73.05 111.594 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.68 169.17 16.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.855 0.36 . . . . 74.21 111.692 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.9 89.85 0.35 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.1 -0.571 . . . . 74.2 112.723 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.72 122.97 72.26 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.462 0.541 . . . . 65.44 112.462 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -95.31 -9.29 1.3 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.121 2.548 . . . . 73.13 113.174 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.31 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.53 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HZ ' HD11 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.11 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.547 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 70.14 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.34 111.662 -177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.33 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.662 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.41 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.04 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.14 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.22 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.24 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.13 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.23 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 71.2 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 74.13 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.41 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.52 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.11 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.05 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.42 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.662 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.03 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.45 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 70.41 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.41 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.4 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.22 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.13 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.12 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 61.34 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.34 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.45 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.2 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HA ' HD11 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.41 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.42 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.23 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.31 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.56 HG22 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.4 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.44 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.02 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.34 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 62.42 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 52.22 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 33.42 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.13 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 45.43 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 62.54 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.32 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.47 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.13 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.53 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.01 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.05 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.22 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.54 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.55 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.04 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.22 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.14 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.44 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.14 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.21 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.34 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.45 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.12 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.41 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.13 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.11 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 71.3 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.24 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.11 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -77.15 92.1 3.77 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 64.34 111.257 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -68.83 148.17 50.66 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.153 -0.476 . . . . 75.35 111.047 174.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.273 -0.87 . . . . 73.43 111.778 -177.889 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.493 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.731 0.3 . . . . 75.03 111.488 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.7 -20.7 66.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.169 0.803 . . . . 42.23 113.169 -174.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.16 -79.73 1.02 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 121.07 -0.586 . . . . 24.1 113.305 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.05 90.07 2.52 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.401 0.62 . . . . 64.43 111.723 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo -89.26 -56.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.591 2.194 . . . . 41.41 114.67 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 73.21 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.515 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 73.44 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.32 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.15 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.51 111.454 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.4 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.14 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.42 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.41 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.44 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.52 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.01 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.31 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.52 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.23 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.522 ' HB3' HD11 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.14 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.35 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.43 111.889 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.54 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.43 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.515 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.34 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.32 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.45 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.45 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 60.44 110.249 172.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.11 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.434 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 73.3 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.24 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.434 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.1 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.4 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.53 111.939 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.41 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.51 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB3' HG23 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.02 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.22 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.22 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' HD11 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.33 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.44 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.2 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.32 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.48 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.12 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.52 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.1 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.33 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.22 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.12 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.54 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 61.21 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.11 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.585 HG22 ' ND2' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.44 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.23 112.182 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.54 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.41 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.585 ' ND2' HG22 ' A' ' 59' ' ' ILE . 27.1 p30 -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.32 112.729 -173.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.11 110.724 179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.03 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.43 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.11 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.33 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 63.13 111.536 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.21 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 43.2 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.42 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 53.33 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.24 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.1 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.34 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.32 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 59.33 -173.59 0.1 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.13 111.801 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -131.14 1.11 4.21 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.118 0.485 . . . . 72.3 110.408 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-N 116.05 -0.523 . . . . 44.31 110.649 178.374 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.6 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 120.915 0.388 . . . . 75.4 111.545 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.14 107.76 9.55 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.89 0.376 . . . . 73.33 111.019 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.07 -74.65 1.99 Allowed Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.103 -0.57 . . . . 75.32 112.799 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -169.46 106.35 0.47 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 120.719 0.295 . . . . 74.54 111.263 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.91 -20.11 34.53 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.558 2.172 . . . . 73.22 112.546 175.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.42 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.24 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.2 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 33.42 110.91 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.14 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.05 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.56 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.42 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.24 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.23 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.443 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.32 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.41 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.4 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 71.04 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 72.15 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.23 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.443 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 71.44 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.01 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.54 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.34 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.51 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 51.35 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.43 111.784 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.43 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.14 110.753 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.03 111.519 178.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 51.04 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.13 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.34 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.12 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.24 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.03 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 71.0 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.14 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.44 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 73.32 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.43 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.13 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.32 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.33 111.92 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.51 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.22 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.539 HG11 HG21 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.11 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.45 111.269 176.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.14 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.45 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.31 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.11 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.42 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.51 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.15 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.34 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 70.13 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.1 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.413 HG23 ' HD2' ' A' ' 22' ' ' PHE . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.14 111.147 174.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.539 HG21 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 71.23 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.31 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 64' ' ' ARG . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.24 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.01 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.22 111.179 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 72.11 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 35.53 111.463 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 72.4 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.22 111.369 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 72.04 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.21 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.24 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.14 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 71.41 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.52 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.4 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -144.63 87.75 1.88 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.41 110.617 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -93.4 -18.24 22.59 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.098 0.475 . . . . 75.13 110.982 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 25.9 m80 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 118.637 -0.697 . . . . 63.22 110.892 174.287 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.519 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.644 0.259 . . . . 73.14 111.179 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.52 29.04 18.17 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.726 0.41 . . . . 71.51 111.979 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.71 179.11 35.5 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.771 -0.728 . . . . 73.12 113.908 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -163.05 74.61 1.96 Allowed Pre-proline 0 CA--C 1.547 0.854 0 CA-C-O 121.341 0.591 . . . . 70.21 111.001 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.63 -59.82 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.012 2.475 . . . . 35.13 113.368 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.24 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.23 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.31 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.02 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.42 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.691 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.32 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.586 ' HG2' ' O ' ' A' ' 9' ' ' TYR . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.54 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.03 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.03 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.44 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.24 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.2 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.22 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 32.35 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.42 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.691 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.52 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 56.1 t-80 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.53 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.15 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 61.22 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.23 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.4 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.42 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.01 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 63.4 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.11 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 62.05 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 73.02 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.4 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.1 110.138 174.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.594 ' O ' HG22 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.1 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.405 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.22 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 73.42 112.498 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 61.2 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.21 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 74.22 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.02 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 65.32 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.42 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.482 ' N ' HG23 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 63.41 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.12 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.45 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 71.13 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.14 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.15 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.33 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 73.52 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.35 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.01 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 61.41 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.51 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.04 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.23 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.54 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.4 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.34 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 64.02 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 53.44 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 65.52 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.491 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.04 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.01 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.41 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 51.34 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.4 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.04 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.42 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.44 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -98.0 -170.99 2.07 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.04 111.198 175.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -109.36 27.63 9.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.929 0.395 . . . . 74.41 111.141 176.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 74' ' ' GLU . 34.1 t-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.665 -0.683 . . . . 72.14 111.907 -178.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.585 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.498 0.189 . . . . 72.13 111.164 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 -64.22 0.53 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.041 0.448 . . . . 53.43 111.517 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.37 76.96 1.98 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 121.161 -0.542 . . . . 62.42 112.573 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -116.48 90.18 29.6 Favored Pre-proline 0 CA--C 1.546 0.806 0 CA-C-O 120.688 0.28 . . . . 71.31 111.081 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HB2' HG23 ' A' ' 7' ' ' THR . 56.4 Cg_endo -91.24 -5.44 4.1 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.825 2.35 . . . . 65.24 113.158 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.15 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 70.21 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.438 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.32 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.24 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.43 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.42 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.562 HG12 HD12 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.14 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.24 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.41 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.35 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.41 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.31 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.13 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.42 112.296 173.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.35 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.33 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 63.23 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.562 HD12 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.53 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 50.42 112.763 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.01 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 72.11 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 44.22 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.24 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.51 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.22 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.41 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.41 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.32 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.33 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.479 ' HB3' HG21 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 71.33 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.33 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.21 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.42 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.438 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 60.43 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.12 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.32 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.44 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.2 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.01 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.24 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.483 HG11 HG21 ' A' ' 62' ' ' THR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 61.01 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.51 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 72.22 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 55.14 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.44 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.24 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 59' ' ' ILE . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.31 110.824 174.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.41 110.82 171.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.24 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 56' ' ' HIS . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 62.52 112.624 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.31 111.672 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 62.31 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.483 HG21 HG11 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.23 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.34 111.555 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.52 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.2 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 62' ' ' THR . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.15 111.355 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 63.14 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.02 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.11 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.32 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.24 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 63.15 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.13 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.21 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.41 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.4 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -80.53 -29.41 37.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.01 110.921 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 66.77 -74.47 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.46 0.704 . . . . 72.03 112.511 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.78 -0.628 . . . . 74.45 111.665 -176.744 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.675 0.274 . . . . 75.35 111.272 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.84 107.45 2.55 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.055 0.391 . . . . 61.11 112.055 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.57 -48.58 0.61 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.873 -0.68 . . . . 75.13 113.889 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CB ' ' HA ' ' A' ' 38' ' ' LEU . 10.3 t70 -94.97 120.49 64.36 Favored Pre-proline 0 CA--C 1.543 0.683 0 N-CA-C 112.324 0.49 . . . . 72.24 112.324 -175.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -89.67 11.15 2.93 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.965 2.443 . . . . 71.55 113.272 174.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.32 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.3 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.43 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.23 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.13 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.638 HG12 HD12 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.02 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.02 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.24 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 63.43 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 70.21 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.1 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.34 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.12 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.22 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 60.12 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.35 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.35 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.638 HD12 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.41 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.2 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.51 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 61.41 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.13 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.14 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.23 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.41 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.53 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 63.32 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.42 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.403 ' HA ' ' CB ' ' A' ' 4' ' ' ASP . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.629 ' HB2' HD11 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.1 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.598 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.23 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.598 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.42 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.587 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.51 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.12 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.629 HD11 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.41 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.42 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.02 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.31 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.574 HG11 HG21 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.51 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.2 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.3 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.24 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 70.31 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 45.55 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.52 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.35 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.24 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.02 110.628 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.04 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.23 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 53.54 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.574 HG21 HG11 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 64.24 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.31 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.32 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.3 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 72.22 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.03 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.21 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.03 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.587 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.22 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.31 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.23 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.11 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.43 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.3 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.2 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.32 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -165.52 -65.01 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.43 110.555 175.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -176.51 102.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.818 -0.628 . . . . 74.54 109.958 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 . . . . . 0 C--O 1.255 1.374 0 CA-C-N 116.056 -0.52 . . . . 71.53 111.094 -173.667 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.714 0.292 . . . . 75.51 111.128 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.43 -172.5 0.38 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.91 0.386 . . . . 61.22 111.203 -178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 5' ' ' PRO . . . 92.54 -63.1 2.31 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.312 -0.47 . . . . 65.34 114.101 175.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.55 113.07 8.51 Favored Pre-proline 0 CA--C 1.545 0.77 0 N-CA-C 113.622 0.971 . . . . 74.41 113.622 -173.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 3' ' ' GLY . 92.0 Cg_endo -102.51 10.15 0.4 Allowed 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 123.669 2.913 . . . . 74.35 112.435 169.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.596 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.21 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 70.22 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.409 ' HA ' ' CE1' ' A' ' 42' ' ' HIS . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.42 111.655 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.596 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.32 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.44 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.32 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.23 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.2 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' ND2' ' A' ' 17' ' ' ASN . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.22 112.893 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.4 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 60.3 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.403 ' ND2' ' HA2' ' A' ' 14' ' ' GLY . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 74.31 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.24 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.42 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.05 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.51 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.42 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.34 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 61.41 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.591 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 32.35 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.21 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.54 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.4 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.43 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.41 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.13 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.31 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 64.0 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.04 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.45 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.34 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.51 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.21 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.55 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' A' ' 8' ' ' PHE . 73.9 m-70 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 73.02 112.088 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.34 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 72.01 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.33 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 71.13 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.14 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.734 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.1 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.15 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.24 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.11 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.14 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.24 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.0 t60 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.45 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.03 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.13 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.12 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.42 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.23 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.23 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 64.25 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.04 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.03 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 65.3 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.44 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.35 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 63.52 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.51 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.24 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 73.04 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.13 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.24 111.694 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.21 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.54 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.35 110.507 174.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -88.63 90.56 8.45 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.456 173.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -65.61 -16.82 64.09 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.228 0.537 . . . . 75.35 110.937 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.494 -0.765 . . . . 74.55 110.592 175.632 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.8 tpp . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.913 0.387 . . . . 74.13 111.511 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.41 -173.7 3.92 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.189 0.519 . . . . 51.2 111.562 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' HD3' ' A' ' 5' ' ' PRO . . . -141.29 152.55 23.38 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 121.192 -0.528 . . . . 45.45 112.466 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -96.06 100.95 7.36 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-O 120.961 0.41 . . . . 74.41 111.53 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HB2' HG23 ' A' ' 7' ' ' THR . 74.0 Cg_endo -76.96 -26.83 7.5 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.282 1.988 . . . . 74.23 112.75 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.43 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.1 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 52.23 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.43 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.41 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.548 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.33 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.759 HG13 ' HB2' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.22 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 63.32 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.54 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 71.54 111.023 175.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.21 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.15 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.53 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.23 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.15 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.12 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.33 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 15' ' ' PHE . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 53.23 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 73.53 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.22 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.56 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.44 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.13 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 34.5 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 45.11 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.33 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.21 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.551 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.34 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.44 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.23 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.01 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.35 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 71.24 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.02 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.41 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.04 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.691 ' HB3' HD12 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.11 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.04 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 63.44 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.3 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.42 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.14 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 62.05 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.504 HG11 HG21 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 73.24 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.1 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.12 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.22 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' A' ' 58' ' ' LEU . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.11 112.901 -172.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 53.24 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.14 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.41 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.53 111.375 179.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.11 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.34 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.24 112.448 -173.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.1 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.504 HG21 HG11 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.21 111.609 -175.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.54 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.691 HD12 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.34 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 71.42 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 42.23 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.41 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.34 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.23 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.12 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.03 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.41 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.24 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.23 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 46.64 113.52 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.31 114.829 170.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -167.24 -33.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.812 -0.631 . . . . 53.54 110.89 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.402 -0.809 . . . . 70.25 110.89 176.589 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.5 ttm . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.42 0.152 . . . . 74.43 110.965 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 175.75 175.43 0.26 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.77 0.428 . . . . 72.21 111.02 -177.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.41 62.82 3.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 121.288 -0.482 . . . . 40.12 112.668 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.9 t0 55.13 90.99 0.08 OUTLIER Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 123.747 0.819 . . . . 72.22 112.229 -176.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -92.87 3.53 3.5 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.987 2.458 . . . . 44.03 113.321 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.31 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 61.53 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.481 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.35 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 71.44 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 53.43 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.518 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.54 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.704 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 62.32 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 35.43 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.11 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.475 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.52 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.34 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 60.22 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.33 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.41 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.04 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 71.54 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.51 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.33 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.43 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.04 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.1 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.23 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.481 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 71.25 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.23 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.23 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.2 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.3 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.32 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.13 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.52 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.12 111.705 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG3' HD11 ' A' ' 45' ' ' ILE . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.12 112.927 -173.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.04 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.12 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.22 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.45 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.05 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 39' ' ' GLU . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.24 111.214 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.23 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.13 111.342 176.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 71.3 112.433 -178.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.22 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.41 ' HB2' ' HE2' ' A' ' 50' ' ' MET . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 71.13 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 71.14 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.33 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 74.33 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.11 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 70.43 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.42 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.55 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 52.54 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.32 111.598 -176.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 65.23 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.674 HG21 HG11 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 73.03 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.2 110.848 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.42 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.1 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.21 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 72.44 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.54 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 65.43 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.33 111.949 -176.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.54 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.42 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.14 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.05 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.42 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.13 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.44 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -74.13 96.9 2.81 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 73.43 109.94 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' HIS . 66.0 t60 -56.16 -23.13 33.03 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.669 0.618 . . . . 72.43 112.669 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 54.4 t-80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.475 -0.774 . . . . 54.33 110.96 -176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo . . . . . 0 CA--C 1.54 0.784 0 CA-C-O 120.812 0.255 . . . . 72.51 112.29 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 64.33 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 61.44 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.14 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 61.22 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.24 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 52.4 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.23 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.14 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.41 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.51 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' ' HB3' ' A' ' 26' ' ' ALA . 3.9 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 53.14 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.4 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.03 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.33 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.22 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.12 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 73.32 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.12 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 51.23 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.43 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 40.53 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.44 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.504 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 2.9 t60 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.15 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 71.34 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.14 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.21 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.31 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.55 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.31 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.21 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.03 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.32 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.03 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.15 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.1 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.11 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.43 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 61.22 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.13 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HG2' ' SD ' ' A' ' 50' ' ' MET . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 61.15 110.851 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 61.41 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.784 HG21 HG21 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.33 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.71 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.4 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.24 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.51 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.41 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.11 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 72.12 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.21 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.55 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.41 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.71 HG23 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.01 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.597 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.44 111.823 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.11 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.784 HG21 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.43 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.597 HD21 ' HA ' ' A' ' 60' ' ' GLU . 11.0 p30 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.01 111.455 -176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.53 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.55 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.41 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.42 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.23 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.34 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.14 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.34 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.32 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.14 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.41 112.39 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 71.12 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 64.21 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 . . . . . 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 73.03 109.866 174.38 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.544 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo . . . . . 0 CA--C 1.541 0.847 0 N-CA-C 113.701 0.616 . . . . 55.34 113.701 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.14 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.52 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 73.21 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.43 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.31 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.599 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.14 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.03 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.33 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.14 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.12 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.13 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.12 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 70.24 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.15 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.24 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.34 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.22 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.53 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.514 HD12 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.11 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.599 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.13 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.2 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.33 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.03 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.01 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.23 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.23 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.12 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.44 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 64.41 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.35 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 63.13 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.11 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.13 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.34 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.53 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.45 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.01 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.01 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 71.14 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 65.0 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.45 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.2 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 73.0 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.31 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.01 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.45 ' N ' HD22 ' A' ' 52' ' ' ASN . 0.9 OUTLIER -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.21 112.106 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 73.42 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.05 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.32 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.41 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.41 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.12 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.24 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.31 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.12 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.12 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.3 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.45 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.31 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.02 111.267 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.51 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.21 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.41 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.03 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.55 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.03 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.11 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.54 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 61.3 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 . . . . . 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 72.35 113.305 173.542 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.726 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo . . . . . 0 CA--C 1.542 0.915 0 CA-C-O 121.023 0.343 . . . . 63.23 112.217 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.44 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.42 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.22 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.34 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 64.42 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.13 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.04 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.53 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.11 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.432 ' OE1' ' HB3' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.52 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.14 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.53 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.45 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.1 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.44 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.23 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.12 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.33 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.21 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.432 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.03 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.41 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.33 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.4 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.31 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.44 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.21 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 64.42 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.43 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.497 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.4 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.52 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.54 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.726 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.32 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.23 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.11 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.33 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.42 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.32 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 60.13 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.31 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.24 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.533 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 73.11 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.42 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.4 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.01 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.533 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.24 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.31 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.2 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.42 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.24 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 73.11 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.44 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.467 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.34 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.44 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.468 ' OG1' HG11 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.41 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.14 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.44 ' O ' HD23 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.22 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.15 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.4 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.31 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.15 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.45 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.34 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.415 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.997 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.43 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.44 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.14 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.21 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 . . . . . 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.45 110.901 -179.829 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.598 ' HD2' HG23 ' A' ' 7' ' ' THR . 4.6 Cg_exo . . . . . 0 CA--C 1.547 1.141 0 N-CA-C 112.801 0.269 . . . . 74.22 112.801 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.44 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.53 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.51 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.603 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 73.43 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.35 111.767 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.22 112.124 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.636 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.02 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.11 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.14 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 26' ' ' ALA . 8.3 tp-100 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.01 111.438 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.21 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.44 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.4 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.469 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.51 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.14 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.33 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.42 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.24 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.33 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.54 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.13 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.45 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.53 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.12 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.13 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.23 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.04 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.34 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.34 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.12 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 71.13 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.44 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.1 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.679 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.35 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.679 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.43 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 52.21 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 64.4 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 63.51 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 46' ' ' ARG . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.12 111.509 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.05 112.015 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.43 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.442 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.24 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.11 111.915 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 70.3 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.23 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.14 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.34 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.24 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.2 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.44 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.3 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.42 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 63' ' ' ASN . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.3 112.657 -171.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 72.33 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.21 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 60' ' ' GLU . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.33 111.38 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.14 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.12 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 74.2 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.12 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.42 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 62.35 111.935 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.1 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.13 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.12 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.12 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.22 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 78' ' ' HIS . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.32 111.693 -177.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.42 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.13 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 75' ' ' HIS . 11.6 t60 . . . . . 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.34 110.224 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.458 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo . . . . . 0 CA--C 1.539 0.747 0 N-CA-C 112.542 0.17 . . . . 51.45 112.542 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.33 112.685 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.14 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.33 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.606 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 62.54 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.21 111.489 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.404 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.03 111.997 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.532 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.34 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.31 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 73.21 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.21 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 64.51 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 54.12 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.51 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 73.54 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 63.22 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 54.41 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.11 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.15 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.532 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.23 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.43 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.41 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.33 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 55.4 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.42 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.04 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.544 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.2 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.4 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.544 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.54 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.51 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.2 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.21 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.13 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.14 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.581 ' O ' HG22 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.54 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.623 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 72.43 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.42 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.3 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.55 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.31 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.34 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.53 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 41.03 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.3 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.44 ' N ' HD22 ' A' ' 52' ' ' ASN . 0.9 OUTLIER -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.31 113.168 -176.516 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 70.01 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.11 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.467 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 61.31 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.34 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 64.1 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.04 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.35 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 73.12 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 74.01 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.33 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 53.13 112.227 -173.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 73.12 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.54 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.623 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.53 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.51 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.21 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.41 111.77 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.23 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.15 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 65.01 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 72.11 110.939 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.43 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 74.41 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 71.31 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.21 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 . . . . . 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.44 110.978 175.996 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.542 0.904 0 CA-C-O 120.961 0.317 . . . . 62.34 111.67 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.14 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.03 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.32 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.543 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.31 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.22 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.21 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.14 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.543 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.41 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.12 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 73.0 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.31 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.13 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.32 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.02 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.14 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.21 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.476 ' HB3' HD11 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 64.52 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.2 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.11 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 51.22 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.477 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.34 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.24 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 64.11 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.4 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 31.45 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.33 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 71.13 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.03 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.45 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.42 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.13 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 39' ' ' GLU . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.4 112.641 -176.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 53.22 111.743 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 37' ' ' ARG . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 63.12 113.159 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.04 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.31 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.44 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.456 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.11 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 53.5 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.01 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.11 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.33 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 54.22 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.4 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.12 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.35 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.12 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 71.13 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.4 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.54 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 54.23 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.01 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.583 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.51 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.12 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 71.25 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.42 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.03 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.32 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.51 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.33 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 54.33 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 41.15 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 63.3 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 62.23 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.34 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.04 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.04 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.53 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.32 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.51 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 73.5 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.44 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 . . . . . 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.43 110.737 175.022 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 CA--C 1.542 0.924 0 N-CA-C 113.261 0.447 . . . . 75.33 113.261 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.05 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 63.03 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 71.15 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 55.15 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.14 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.12 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.54 112.381 -174.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 65.43 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.31 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.23 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.668 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.34 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.33 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.23 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.23 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.11 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.34 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 44.15 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.13 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 74.24 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.288 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.468 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.43 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.668 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.35 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.45 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.491 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.12 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.12 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.12 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.11 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.34 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.42 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.53 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.11 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.46 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.52 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.34 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.52 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.45 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.22 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.14 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' OE1' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.01 112.421 -179.285 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.32 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.32 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.427 ' HB2' HG21 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.31 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.453 ' HA ' ' HE2' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.13 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.42 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.611 HG11 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 62.1 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.453 ' HE2' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.51 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.22 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.01 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.44 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.04 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 43.14 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 72.1 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.42 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.33 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.21 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.02 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.44 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.611 HG21 HG11 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.45 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.2 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.33 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG21 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.23 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.24 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.21 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.41 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.02 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.13 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.32 110.498 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 52.25 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.4 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 64.42 111.658 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.24 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 74.31 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.24 109.205 170.89 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo . . . . . 0 CA--C 1.546 1.12 0 N-CA-C 113.855 0.675 . . . . 74.22 113.855 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.42 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.34 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.34 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.2 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.23 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.3 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 72.04 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.11 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.13 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.13 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 0.0 OUTLIER -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.52 111.575 -177.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 64.14 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.42 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.583 HD22 ' N ' ' A' ' 19' ' ' ASN . 0.8 OUTLIER -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.55 113.587 -164.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 45.03 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.23 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 52.5 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 31.32 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.24 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.01 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 72.22 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.24 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.593 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.04 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.02 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.14 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.23 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.33 111.094 173.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.54 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 61.3 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 73.2 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.436 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.03 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 73.45 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.12 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.31 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.651 ' HB3' HD12 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.22 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.31 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.1 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.44 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.33 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.21 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.32 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.524 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.41 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.445 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.32 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 53.15 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 64.21 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.524 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.53 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.452 HG23 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.15 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.452 ' H ' HG23 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.21 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.44 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.44 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.55 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 71.41 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.03 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.31 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 54.43 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.45 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.651 HD12 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.41 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 72.42 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.32 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 53.21 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.456 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.12 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.31 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.33 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.53 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 61.22 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.11 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 64.53 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 . . . . . 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.2 112.476 -175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 CA--C 1.547 1.156 0 N-CA-C 113.847 0.672 . . . . 62.5 113.847 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.21 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.45 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.32 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 73.12 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.42 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.3 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.41 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.24 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.43 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.54 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.15 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.45 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.52 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.32 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.12 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.52 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.33 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.12 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.501 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.2 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.4 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.11 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.53 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.43 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 62.51 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.14 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.44 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.42 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.04 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.43 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.568 ' O ' HG22 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.14 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.53 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.1 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.34 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.44 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.31 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.33 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.34 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.45 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.585 HG11 HG21 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.44 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG2' HD13 ' A' ' 59' ' ' ILE . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.04 110.974 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.423 ' HB3' ' HA ' ' A' ' 48' ' ' TYR . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.14 111.87 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 42.24 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.02 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.13 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.2 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.44 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.13 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.501 HD22 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.12 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.4 HD13 ' HG2' ' A' ' 50' ' ' MET . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.44 112.313 -177.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.4 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.42 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.585 HG21 HG11 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 61.35 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.2 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 72.22 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.51 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.34 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.11 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.23 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.32 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.14 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.02 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.22 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.04 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.22 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 63.43 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.15 112.406 178.411 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo . . . . . 0 CA--C 1.539 0.763 0 N-CA-C 113.199 0.423 . . . . 74.14 113.199 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.24 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.532 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 64.43 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.03 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.42 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.714 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.44 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.24 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.14 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' HG2' ' HB2' ' A' ' 27' ' ' GLU . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.12 111.207 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.4 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.02 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.12 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 63.42 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.31 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.54 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.02 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.33 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.24 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.714 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.3 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.1 111.529 -177.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.34 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.23 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.24 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.15 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.35 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.02 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.31 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 35' ' ' PHE . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.43 112.578 175.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.4 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.11 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.34 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.13 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.13 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.23 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.34 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.54 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.34 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.22 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.53 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.42 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.21 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.11 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.02 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 54.5 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.41 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.21 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.41 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.3 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 73.24 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.11 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.469 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.14 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.52 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.14 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.51 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 65.15 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 60.35 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.3 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.532 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 72.23 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 55.34 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 23.42 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.01 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.04 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.35 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 71.34 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.21 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.55 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.55 111.701 179.152 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 CA--C 1.547 1.132 0 CA-C-O 120.97 0.321 . . . . 61.44 112.702 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.44 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.35 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 62.13 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.412 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.23 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 72.25 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.51 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.2 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 64.42 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.42 111.519 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.13 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.41 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.35 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 34.4 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HD1' HG23 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 53.24 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 21.33 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.42 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 54.34 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 64.01 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 71.21 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 62.43 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 55.01 111.131 176.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.32 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.42 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.42 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.43 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.21 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.05 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.03 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.31 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.35 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.52 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.565 ' O ' HG22 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.34 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.551 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 73.51 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.33 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 51.42 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.758 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.14 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.12 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.51 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.42 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.02 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.654 ' HG2' HG23 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.43 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.34 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.04 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.52 112.164 -174.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.32 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.43 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.14 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.22 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.1 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.04 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.53 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.55 HG23 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 54.34 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.65 HG21 HG21 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.43 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.412 ' ND2' HG22 ' A' ' 59' ' ' ILE . 94.3 m-20 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 65.14 112.025 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.54 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.35 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.44 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 74.32 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.42 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.551 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.31 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.02 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.22 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.24 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.35 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.02 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.54 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.44 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.13 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.44 110.759 172.972 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo . . . . . 0 CA--C 1.543 0.944 0 N-CA-C 113.174 0.413 . . . . 73.13 113.174 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.31 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.53 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HZ ' HD11 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.11 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.547 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 70.14 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.34 111.662 -177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.33 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.662 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.41 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.04 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.14 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.22 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.24 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.13 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.23 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 71.2 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 74.13 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.41 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.52 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.11 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.05 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.42 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.662 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.03 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.45 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 70.41 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.41 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.4 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.22 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.13 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.12 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 61.34 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.34 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.45 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.2 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HA ' HD11 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.41 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.42 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.23 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.31 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.56 HG22 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.4 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.44 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.02 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.34 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 62.42 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 52.22 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 33.42 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.13 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 45.43 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 62.54 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.32 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.47 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.13 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.53 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.01 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.05 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.22 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.54 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.55 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.04 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.22 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.14 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.44 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.14 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.21 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.34 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.45 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.12 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.41 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.13 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.11 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 71.3 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.24 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.11 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 . . . . . 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 64.34 111.257 175.226 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo . . . . . 0 CA--C 1.547 1.157 0 N-CA-C 114.67 0.988 . . . . 41.41 114.67 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 73.21 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.515 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 73.44 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.32 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.15 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.51 111.454 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.4 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.14 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.42 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.41 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.44 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.52 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.01 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.31 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.52 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.23 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.522 ' HB3' HD11 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.14 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.35 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.43 111.889 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.54 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.43 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.515 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.34 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.32 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.45 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.45 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 60.44 110.249 172.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.11 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.434 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 73.3 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.24 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.434 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.1 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 38' ' ' LEU . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.4 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.53 111.939 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.41 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.51 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB3' HG23 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.02 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.22 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.22 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' HD11 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.33 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.44 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.2 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.32 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.48 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.12 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.52 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.1 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.33 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.22 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.12 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.54 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 61.21 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.11 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.435 HG22 ' OD1' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.44 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HA ' HD21 ' A' ' 63' ' ' ASN . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.23 112.182 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.54 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.41 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.672 HD22 ' N ' ' A' ' 64' ' ' ARG . 0.3 OUTLIER -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.32 112.729 -173.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.672 ' N ' HD22 ' A' ' 63' ' ' ASN . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.11 110.724 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.03 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.43 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.11 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.33 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 63.13 111.536 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.21 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 43.2 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.42 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 53.33 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.24 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.1 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.34 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.32 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 . . . . . 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.13 111.801 -178.79 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo . . . . . 0 CA--C 1.538 0.681 0 CA-C-O 120.79 0.246 . . . . 73.22 112.546 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.42 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.24 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.2 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 33.42 110.91 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.14 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.05 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.56 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.42 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.24 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.23 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.443 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.32 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.41 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.4 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 71.04 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 72.15 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.23 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.443 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 71.44 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.01 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.54 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.34 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.51 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 51.35 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.43 111.784 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.43 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.14 110.753 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.03 111.519 178.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 51.04 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.13 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.34 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.12 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.24 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.03 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 71.0 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.14 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.44 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 73.32 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.43 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.13 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.32 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.33 111.92 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.51 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.22 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.539 HG11 HG21 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.11 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.45 111.269 176.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.14 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.45 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.31 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.11 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.42 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.51 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.15 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.34 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 70.13 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.1 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.413 HG23 ' HD2' ' A' ' 22' ' ' PHE . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.14 111.147 174.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.539 HG21 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 71.23 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.31 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 64' ' ' ARG . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.24 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.01 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.22 111.179 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 72.11 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 35.53 111.463 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 72.4 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.22 111.369 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 72.04 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.21 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.24 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.14 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 71.41 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.52 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.4 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 . . . . . 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.41 110.617 -179.926 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 N-CA-C 113.368 0.488 . . . . 35.13 113.368 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.24 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.23 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.31 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.02 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.42 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.691 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.32 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.586 ' HG2' ' O ' ' A' ' 9' ' ' TYR . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.54 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.03 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.03 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.44 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.24 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.2 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.22 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 32.35 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.42 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.691 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.52 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.53 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.15 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 61.22 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.23 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.4 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.42 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.01 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 63.4 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.11 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 62.05 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 73.02 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.4 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.1 110.138 174.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.594 ' O ' HG22 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.1 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.405 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.22 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 73.42 112.498 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 61.2 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.21 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 74.22 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.02 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 65.32 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.42 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.482 ' N ' HG23 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 63.41 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.12 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.45 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 71.13 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.14 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.15 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.33 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 73.52 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.35 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.01 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 61.41 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.51 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.04 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.23 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.54 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.4 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.34 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 64.02 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 53.44 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 65.52 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.491 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.04 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.01 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.41 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 51.34 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.4 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.04 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.42 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.44 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.04 111.198 175.586 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HB2' HG23 ' A' ' 7' ' ' THR . 56.4 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 N-CA-C 113.158 0.407 . . . . 65.24 113.158 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.15 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 70.21 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.438 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.32 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.24 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.43 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.42 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.562 HG12 HD12 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.14 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.24 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.41 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.35 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.41 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.31 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.13 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.422 ' HB3' HE22 ' A' ' 57' ' ' GLN . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.42 112.296 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.35 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.33 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 63.23 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.562 HD12 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.53 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 50.42 112.763 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.01 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 72.11 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 44.22 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.24 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.51 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.22 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.41 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.41 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.32 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.33 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.479 ' HB3' HG21 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 71.33 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.33 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.21 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.42 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.438 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 60.43 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.12 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.32 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.44 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.2 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.01 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.24 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.483 HG11 HG21 ' A' ' 62' ' ' THR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 61.01 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.51 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 72.22 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 55.14 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.44 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.24 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 59' ' ' ILE . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.31 110.824 174.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' HB3' ' A' ' 21' ' ' PRO . 14.9 mm100 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.41 110.82 171.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.24 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 56' ' ' HIS . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 62.52 112.624 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.701 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.31 111.672 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 62.31 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.483 HG21 HG11 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.23 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.701 HD21 ' HA ' ' A' ' 60' ' ' GLU . 11.1 p30 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.34 111.555 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.52 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.2 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 62' ' ' THR . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.15 111.355 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 63.14 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.02 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.11 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.32 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.24 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 63.15 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.13 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.21 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.41 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.4 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 . . . . . 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.01 110.921 176.239 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo . . . . . 0 CA--C 1.545 1.07 0 N-CA-C 113.272 0.451 . . . . 71.55 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.32 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.3 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.43 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.23 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.13 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.638 HG12 HD12 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.02 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.02 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.24 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 63.43 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 70.21 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.1 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.34 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.12 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.22 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 60.12 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.35 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.35 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.638 HD12 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.41 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.2 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.51 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 61.41 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.13 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.14 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.23 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.41 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.53 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 63.32 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.42 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.629 ' HB2' HD11 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.1 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.598 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.23 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.598 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.42 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.587 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.51 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.12 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.629 HD11 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.41 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.42 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.02 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.31 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.574 HG11 HG21 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.51 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.2 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.3 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.24 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 70.31 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 45.55 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.52 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.35 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.24 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.02 110.628 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.04 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.23 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 53.54 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.574 HG21 HG11 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 64.24 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.31 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.32 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.3 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 72.22 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.03 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.21 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.03 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.587 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.22 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.31 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.23 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.11 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.43 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.3 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.2 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.32 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 . . . . . 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.43 110.555 175.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo . . . . . 0 CA--C 1.545 1.065 0 CA-C-O 120.69 0.204 . . . . 74.35 112.435 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.596 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.21 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 70.22 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.42 111.655 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.596 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.32 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.44 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.32 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.23 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.2 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' ND2' ' A' ' 17' ' ' ASN . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.22 112.893 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.4 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 60.3 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.403 ' ND2' ' HA2' ' A' ' 14' ' ' GLY . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 74.31 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.24 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.42 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.05 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.51 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.42 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.34 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 61.41 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.591 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 32.35 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.21 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.54 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.4 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.43 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.41 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.13 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.31 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 64.0 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.04 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.45 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.34 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.51 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.21 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.55 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 73.02 112.088 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.34 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 72.01 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.33 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 71.13 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.14 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.734 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.1 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.15 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.24 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.11 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.14 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.24 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.45 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.03 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.13 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.12 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.42 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.23 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.23 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 64.25 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.04 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.03 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 65.3 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.44 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.35 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 63.52 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.51 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.24 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 73.04 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.13 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.24 111.694 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.21 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.54 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.35 110.507 174.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 . . . . . 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.456 173.191 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HB2' HG23 ' A' ' 7' ' ' THR . 74.0 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 112.75 0.25 . . . . 74.23 112.75 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.43 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.1 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 52.23 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.43 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.41 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.548 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.33 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.759 HG13 ' HB2' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.22 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 63.32 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.54 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 71.54 111.023 175.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.21 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.15 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.53 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.23 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.15 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.12 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.33 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 15' ' ' PHE . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 53.23 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 73.53 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.22 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.56 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.44 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.13 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 34.5 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 45.11 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.33 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.21 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.551 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.34 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.44 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.23 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.01 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.35 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 71.24 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.02 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.41 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.04 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.691 ' HB3' HD12 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.11 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.04 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 63.44 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.3 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.42 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.14 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 62.05 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.504 HG11 HG21 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 73.24 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.1 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.12 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.22 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' A' ' 58' ' ' LEU . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.11 112.901 -172.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 53.24 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.14 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.41 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.575 ' H ' ' NE2' ' A' ' 57' ' ' GLN . 2.1 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.53 111.375 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.11 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.34 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.56 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.24 112.448 -173.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.1 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.504 HG21 HG11 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.56 HD21 ' HA ' ' A' ' 60' ' ' GLU . 9.6 p30 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.21 111.609 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.54 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.691 HD12 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.34 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 71.42 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 42.23 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.41 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.34 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.23 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.12 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.03 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.41 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.24 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.23 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 . . . . . 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.31 114.829 170.72 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo . . . . . 0 CA--C 1.541 0.853 0 N-CA-C 113.321 0.47 . . . . 44.03 113.321 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.31 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 61.53 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.481 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.35 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 71.44 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 53.43 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.518 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.54 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.704 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 62.32 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 35.43 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.11 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.475 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.52 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.34 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 60.22 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.33 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.41 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.04 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 71.54 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.51 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.33 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.43 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.04 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.1 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.23 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.481 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 71.25 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.23 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.23 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.2 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.3 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.32 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.13 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.52 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.12 111.705 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG3' HD11 ' A' ' 45' ' ' ILE . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.12 112.927 -173.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.04 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.12 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.22 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.45 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.05 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 39' ' ' GLU . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.24 111.214 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.23 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.13 111.342 176.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 71.3 112.433 -178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.22 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.41 ' HB2' ' HE2' ' A' ' 50' ' ' MET . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 71.13 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 71.14 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.33 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 74.33 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.11 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 70.43 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.42 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.55 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 52.54 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.691 ' HA ' HD21 ' A' ' 63' ' ' ASN . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.32 111.598 -176.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 65.23 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.674 HG21 HG11 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 73.03 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.691 HD21 ' HA ' ' A' ' 60' ' ' GLU . 9.4 p30 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.2 110.848 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.42 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.1 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.21 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 72.44 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.54 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 65.43 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.33 111.949 -176.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.54 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.42 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.14 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.05 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.42 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.13 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.44 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 73.43 109.94 174.805 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.9 mmm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.686 0.279 . . . . 71.23 111.031 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.0 127.6 32.76 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.995 0.426 . . . . 71.15 111.896 178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.02 82.35 0.35 Allowed Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.196 -0.456 . . . . 53.2 112.042 177.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -109.87 98.17 32.62 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 112.393 0.516 . . . . 73.45 112.393 -176.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.43 -20.32 5.94 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 122.323 2.016 . . . . 72.51 112.29 173.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.0 mtt 52.44 33.53 13.35 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.777 0.658 . . . . 64.33 112.777 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -50.38 -59.03 4.4 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 112.393 0.516 . . . . 61.44 112.393 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -52.18 -43.14 63.99 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 116.17 -0.468 . . . . 75.14 111.724 178.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' A' ' 12' ' ' ILE . 42.5 t80 -67.64 -37.29 82.23 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 120.889 0.376 . . . . 61.22 111.209 -178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -61.24 -35.24 76.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.118 0.485 . . . . 74.24 111.061 176.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -69.31 -43.26 74.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.321 -0.4 . . . . 52.4 111.646 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.441 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.8 tp -79.51 -20.87 12.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 111.998 0.37 . . . . 75.23 111.998 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 40.7 ttm -63.08 143.69 57.56 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.197 0.522 . . . . 73.14 110.416 174.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.15 -43.05 1.77 Allowed Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.962 -0.855 . . . . 55.41 110.962 -168.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -74.9 -34.68 62.2 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.18 0.514 . . . . 71.51 110.303 172.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HB3' ' HB3' ' A' ' 26' ' ' ALA . 3.9 pt20 -76.57 86.29 3.26 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.631 0.729 . . . . 53.14 110.975 175.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -173.03 -49.84 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.437 -0.802 . . . . 74.4 109.259 177.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -100.05 159.32 15.19 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.407 -0.815 . . . . 75.03 110.208 172.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -68.21 86.81 0.27 Allowed 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.048 0.451 . . . . 62.33 111.467 -178.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 44.6 p -127.21 144.34 50.28 Favored Pre-proline 0 N--CA 1.473 0.707 0 CA-C-N 116.333 -0.394 . . . . 72.22 111.223 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -52.52 -36.39 70.37 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.544 2.163 . . . . 70.12 112.573 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -68.57 -41.94 79.01 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.92 -0.582 . . . . 73.32 110.675 176.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.73 -36.35 93.18 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.991 -0.55 . . . . 50.12 112.992 178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.4 mt -57.37 -37.91 59.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 CA-C-O 120.859 0.361 . . . . 51.23 111.175 177.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.24 -58.31 9.06 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.439 -0.346 . . . . 74.43 110.365 176.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 16' ' ' GLN . . . -55.93 -42.84 76.74 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.032 0.444 . . . . 40.53 111.677 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -61.97 -47.89 82.81 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.043 -0.526 . . . . 63.44 111.248 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.504 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 2.9 t60 -70.28 -36.08 74.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 111.877 0.325 . . . . 74.15 111.877 -177.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 m -75.77 -29.3 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 121.78 -0.575 . . . . 71.34 110.979 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -69.8 -16.29 63.26 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.077 0.465 . . . . 72.14 110.575 175.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 36.1 tt0 -63.84 -36.45 83.95 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.044 -0.526 . . . . 72.21 111.346 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -74.03 166.91 22.55 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 120.973 0.416 . . . . 74.31 111.045 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.28 -22.21 64.75 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.141 -0.349 . . . . 70.55 111.818 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 62.25 18.33 10.07 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.945 0.402 . . . . 74.31 111.98 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -76.1 125.69 87.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 116.378 -0.374 . . . . 74.0 110.649 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.58 138.52 58.07 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.04 2.494 . . . . 74.21 113.894 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -123.82 -69.39 0.82 Allowed 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.32 0.581 . . . . 64.03 110.637 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -169.15 69.59 0.07 Allowed 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.599 -0.728 . . . . 73.32 109.065 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -78.61 -70.27 0.51 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.403 -0.817 . . . . 74.03 111.24 -175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 64.53 -69.46 0.09 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.29 0.636 . . . . 72.15 112.568 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -109.0 -178.35 3.55 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.917 0.389 . . . . 73.1 111.18 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -102.9 -27.49 12.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.819 0.343 . . . . 73.11 111.841 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -61.39 -39.75 91.82 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.702 0.287 . . . . 72.43 111.736 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.1 m -57.81 -41.53 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 120.929 0.395 . . . . 61.22 111.224 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.7 mt -61.53 -42.68 94.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.152 0.501 . . . . 74.13 110.505 176.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.418 ' HG2' ' SD ' ' A' ' 50' ' ' MET . 21.3 ttm180 -54.86 -50.46 68.62 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.628 -0.715 . . . . 61.15 110.851 176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.12 80.0 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.135 -0.484 . . . . 75.0 112.058 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -60.39 -55.71 30.27 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.091 0.404 . . . . 61.41 112.091 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.784 HG21 HG21 ' A' ' 62' ' ' THR . 32.4 m -61.58 -39.47 83.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.575 0 N-CA-C 112.159 0.429 . . . . 72.33 112.159 -177.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.71 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.4 mtp -71.28 -22.48 61.95 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 111.929 0.344 . . . . 75.4 111.929 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.8 t -81.13 -33.87 32.88 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.75 0.31 . . . . 63.24 111.45 178.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -87.31 -53.62 4.74 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 120.893 0.378 . . . . 54.51 111.815 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -84.64 118.95 24.7 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 120.775 0.321 . . . . 74.41 111.349 -178.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 12.0 t -89.38 -11.47 43.15 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.945 0.403 . . . . 65.11 110.882 175.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.43 121.15 14.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.005 -0.543 . . . . 72.12 111.262 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 m80 -58.53 -42.79 88.57 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.205 -0.452 . . . . 62.21 112.144 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -62.93 -41.45 99.49 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.158 0.429 . . . . 63.55 112.158 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 53.9 mt -66.26 -41.33 90.09 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.089 0.471 . . . . 61.41 110.918 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.71 HG23 ' HG2' ' A' ' 50' ' ' MET . 67.5 mt -65.23 -51.87 59.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.26 -0.427 . . . . 73.01 111.406 175.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.597 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.0 tt0 -56.52 -52.14 65.88 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.852 -0.613 . . . . 64.44 111.823 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.9 m -51.19 -45.43 61.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.983 0.421 . . . . 75.11 111.452 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.784 HG21 HG21 ' A' ' 49' ' ' VAL . 87.7 m -62.79 -58.07 8.72 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.399 0.518 . . . . 74.43 112.399 -178.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.597 HD21 ' HA ' ' A' ' 60' ' ' GLU . 11.0 p30 -67.42 -24.18 65.62 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 121.991 -0.443 . . . . 75.01 111.455 -176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 61.2 ttt180 -65.35 -54.92 21.79 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.803 0.335 . . . . 60.53 110.579 173.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.48 -44.95 85.3 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.926 0.393 . . . . 74.55 111.636 178.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.8 mt -57.79 -50.12 78.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 116.387 -0.37 . . . . 72.41 111.291 175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.5 t -54.58 -48.51 72.01 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.065 0.459 . . . . 74.42 111.539 178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 84.9 mt -59.62 -51.26 70.6 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.138 -0.483 . . . . 73.23 111.415 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -63.16 -9.51 11.24 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.774 0.657 . . . . 74.34 112.774 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.9 mmt -97.18 -62.06 1.31 Allowed 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.793 0.33 . . . . 74.5 110.724 173.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.57 -46.49 89.65 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.484 0.55 . . . . 41.14 112.484 -177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -62.25 -41.91 98.85 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.116 0.484 . . . . 54.34 111.155 179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.4 tp -61.7 -55.44 30.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.083 -0.508 . . . . 73.32 111.175 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -56.17 -44.84 79.75 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.233 -0.439 . . . . 54.14 111.449 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.41 ' O ' ' HB2' ' A' ' 79' ' ' HIS . 43.9 m80 -79.31 5.86 11.39 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.39 0.515 . . . . 71.41 112.39 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.7 m170 -105.99 -14.58 15.14 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.734 0.302 . . . . 71.12 110.851 166.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 67.6 m-70 -86.38 -27.84 23.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.373 0.606 . . . . 64.21 109.867 166.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -134.02 101.82 5.19 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.69 -0.686 . . . . 73.03 109.866 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 16.4 t-80 -132.54 86.86 2.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.179 0.437 . . . . 74.34 112.179 -176.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 44.2 t-80 . . . . . 0 C--O 1.252 1.196 0 CA-C-O 118.5 -0.762 . . . . 64.51 112.534 178.559 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.433 ' SD ' ' C ' ' A' ' 1' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.762 0.315 . . . . 71.11 110.535 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.04 59.74 3.36 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.491 0.662 . . . . 61.22 110.197 176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.87 172.06 20.88 Favored Glycine 0 CA--C 1.524 0.6 0 CA-C-N 115.341 -0.845 . . . . 50.12 111.162 -173.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 56.29 83.33 0.23 Allowed Pre-proline 0 CA--C 1.546 0.794 0 CA-C-N 117.113 0.457 . . . . 71.21 110.751 -176.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.544 ' HD2' ' HB3' ' A' ' 39' ' ' GLU . 18.2 Cg_endo -58.77 -22.64 62.66 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 122.668 2.245 . . . . 55.34 113.701 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.459 ' O ' ' N ' ' A' ' 8' ' ' PHE . 86.4 mtp 56.69 -82.78 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 112.368 0.507 . . . . 71.14 112.368 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 59.6 p 39.72 -79.35 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.245 1.018 . . . . 73.52 113.514 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.459 ' N ' ' O ' ' A' ' 6' ' ' MET . 74.6 t80 -61.0 -33.94 74.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.726 0.298 . . . . 73.21 111.417 -178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 13' ' ' MET . 79.3 t80 -56.56 -41.9 77.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.025 0.44 . . . . 73.43 110.85 176.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -69.68 -44.66 70.01 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.091 0.472 . . . . 52.43 110.761 176.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 86.8 t80 -57.7 -51.93 67.54 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.869 -0.605 . . . . 75.31 112.054 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.599 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.7 tp -64.45 -38.31 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 112.019 0.378 . . . . 73.14 112.019 -175.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.478 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 63.3 mtm -62.26 -22.65 66.16 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 111.794 0.294 . . . . 71.03 111.794 178.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.88 -31.76 68.81 Favored Glycine 0 CA--C 1.529 0.958 0 C-N-CA 121.058 -0.591 . . . . 72.33 112.763 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -90.39 -7.78 52.31 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.834 0.35 . . . . 73.14 111.602 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -10.0 57.63 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.621 0.368 . . . . 71.12 111.729 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -72.26 -54.4 9.68 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.788 0.327 . . . . 55.13 111.377 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.48 166.6 16.19 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.158 0.504 . . . . 70.12 111.803 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -68.2 89.73 0.33 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.124 0.488 . . . . 70.24 110.42 175.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.9 p -135.35 146.54 58.35 Favored Pre-proline 0 N--CA 1.47 0.529 0 CA-C-N 116.364 -0.38 . . . . 72.15 111.499 -178.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.09 -25.31 77.3 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 122.091 1.861 . . . . 75.24 111.61 173.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -67.01 -38.44 85.98 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.831 -0.622 . . . . 75.34 110.447 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.54 -39.51 95.1 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.907 -0.588 . . . . 71.22 112.627 175.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.9 mt -60.65 -39.93 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.039 0.447 . . . . 75.53 110.883 176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.514 HD12 HG12 ' A' ' 12' ' ' ILE . 3.1 tm? -62.49 -47.09 85.5 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.012 0.434 . . . . 75.11 110.045 174.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.599 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.85 -53.3 59.95 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.037 -0.528 . . . . 63.13 112.396 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -63.81 -30.17 71.29 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.774 -0.194 . . . . 75.2 111.508 -178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -75.24 -39.02 60.31 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 111.911 0.338 . . . . 74.33 111.911 -179.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.5 m -75.6 -23.0 16.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 121.109 0.48 . . . . 72.03 111.326 177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -77.18 -47.28 20.74 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.965 -0.561 . . . . 72.01 110.799 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -98.37 -147.43 0.32 Allowed 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 115.912 -0.585 . . . . 75.23 110.883 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t0 69.52 -73.25 0.09 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.353 0.501 . . . . 73.23 112.353 174.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -151.98 -36.42 0.12 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.933 0.346 . . . . 75.12 111.933 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 54.69 27.13 8.28 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.161 0.505 . . . . 72.44 111.82 -179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -63.8 116.52 27.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 115.992 -0.549 . . . . 64.41 112.149 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.61 149.54 43.9 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.54 2.16 . . . . 64.35 112.996 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.8 mmm180 -112.46 -63.62 1.41 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.033 0.445 . . . . 63.13 110.603 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 29.1 tp 177.82 79.93 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.794 0.838 . . . . 75.11 108.799 176.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.544 ' HB3' ' HD2' ' A' ' 5' ' ' PRO . 3.5 mp0 -77.67 88.6 3.95 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 115.689 -0.687 . . . . 75.13 112.246 -168.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -123.36 -48.57 1.95 Allowed 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.088 -0.505 . . . . 74.34 111.006 174.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -111.94 155.29 23.94 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.166 0.507 . . . . 75.53 111.653 177.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 67.3 m80 -87.66 -28.83 21.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.931 0.396 . . . . 74.45 111.49 177.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -51.88 -40.0 59.9 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.558 0.577 . . . . 63.01 112.558 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.4 m -68.59 -27.27 35.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 113.005 0.743 . . . . 71.01 113.005 -173.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 63.0 mt -56.09 -34.42 38.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-O 121.046 0.451 . . . . 71.14 111.504 -177.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -55.78 -39.63 71.52 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.961 -0.563 . . . . 65.0 112.133 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.42 -44.99 77.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.142 0.423 . . . . 72.45 112.142 -176.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -58.72 -54.28 48.87 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.367 0.506 . . . . 64.2 112.367 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.1 m -54.17 -40.98 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 N-CA-C 112.541 0.571 . . . . 73.0 112.541 -175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.7 mtm -68.24 -34.25 75.88 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 120.957 0.408 . . . . 74.31 111.727 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 65.1 m -90.41 -1.51 57.91 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 111.998 0.37 . . . . 75.01 111.998 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.45 ' N ' HD22 ' A' ' 52' ' ' ASN . 0.9 OUTLIER -107.23 -60.68 1.65 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.106 0.409 . . . . 75.21 112.106 178.377 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 91.2 m-85 -86.46 175.89 8.14 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.716 0.636 . . . . 73.42 112.716 -172.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.8 p -129.38 -32.58 1.97 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.817 -0.629 . . . . 73.05 111.679 177.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -59.11 157.31 10.51 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.058 0.456 . . . . 64.32 111.857 178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -63.65 -67.25 0.44 Allowed 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.317 -0.402 . . . . 74.41 111.627 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -62.97 -32.13 73.39 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.345 0.869 . . . . 70.41 113.345 -172.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 25' ' ' LEU . 74.2 mt -63.69 -18.63 64.19 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 111.987 0.365 . . . . 73.12 111.987 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 66.1 mt -113.38 -56.66 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.07 0.462 . . . . 64.5 110.971 176.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -45.48 -47.7 14.03 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.693 0.797 . . . . 73.24 112.515 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 97.4 m -52.12 -58.47 6.46 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 120.835 0.35 . . . . 71.31 111.712 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 42.0 m -63.37 -52.93 59.65 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.773 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -56.43 -47.65 78.65 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.108 0.48 . . . . 74.12 111.681 -178.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 64' ' ' ARG . 38.6 ttt180 -67.44 -47.61 69.66 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.19 -0.459 . . . . 74.12 111.121 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.08 -48.99 75.04 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.728 0.299 . . . . 52.3 111.761 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.413 ' O ' ' HG3' ' A' ' 70' ' ' MET . 58.1 mt -59.41 -35.22 57.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 120.921 0.391 . . . . 75.45 111.161 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 38.5 t -63.62 -44.22 94.54 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.011 0.434 . . . . 73.31 110.905 174.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.6 mm? -62.94 -34.16 76.89 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.401 -0.363 . . . . 75.02 111.267 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -63.27 -44.65 94.52 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.614 0.245 . . . . 75.51 110.953 173.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 66' ' ' ILE . 63.5 mtt -57.34 -47.14 82.36 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.134 0.493 . . . . 74.21 111.318 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.5 -54.58 22.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.159 -0.473 . . . . 61.41 112.055 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.3 t30 -58.99 -47.13 86.27 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.052 -0.522 . . . . 75.03 112.023 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -55.93 26.82 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.802 0.334 . . . . 72.55 110.985 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.4 -32.83 74.46 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.546 0.573 . . . . 73.03 112.546 -177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.0 t-80 -75.14 -35.54 61.66 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.016 0.436 . . . . 72.11 111.041 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -71.17 -39.01 72.14 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.065 0.46 . . . . 74.54 110.43 177.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -78.01 -11.47 59.91 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-N 116.038 -0.528 . . . . 61.3 111.045 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 65.13 96.5 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.305 0.854 . . . . 72.35 113.305 173.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -156.02 127.06 6.99 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.262 -0.426 . . . . 63.5 111.475 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.6 t60 . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.626 -0.702 . . . . 74.34 110.711 175.478 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.484 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.7 0.286 . . . . 74.24 111.389 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.25 86.92 3.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.197 0.523 . . . . 74.12 111.458 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 140.16 -164.7 26.15 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 116.045 -0.525 . . . . 71.22 112.271 -178.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -148.78 99.37 3.54 Favored Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 117.387 0.594 . . . . 73.22 112.193 177.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.726 ' HB3' ' HA ' ' A' ' 40' ' ' GLU . 4.1 Cg_exo -79.17 -7.14 15.14 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 123.126 2.551 . . . . 63.23 112.217 171.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.4 mtp -80.44 3.47 21.31 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.298 -0.41 . . . . 60.44 111.866 -175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.4 p -48.3 -36.94 15.2 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 112.679 0.622 . . . . 75.42 112.679 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -56.57 -49.32 75.21 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.266 0.555 . . . . 75.22 111.008 173.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.553 ' O ' ' HG3' ' A' ' 13' ' ' MET . 48.0 t80 -65.47 -41.63 93.12 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.897 -0.592 . . . . 74.34 110.623 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -55.65 -37.02 67.7 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.621 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -63.54 -56.56 15.07 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.362 -0.381 . . . . 64.42 111.217 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 tp -64.83 -28.12 44.06 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 N-CA-C 111.99 0.367 . . . . 64.13 111.99 -178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.9 mtp -58.62 -25.5 62.73 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.24 -0.287 . . . . 74.04 111.454 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -69.75 -16.09 71.87 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 121.386 -0.435 . . . . 55.53 113.099 177.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -117.35 12.46 14.28 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 120.873 0.368 . . . . 70.11 111.326 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.432 ' OE1' ' HB3' ' A' ' 26' ' ' ALA . 24.0 tp60 -82.06 -20.12 38.88 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.723 0.638 . . . . 72.52 112.723 -174.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.85 36.35 0.33 Allowed 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.082 0.467 . . . . 70.14 111.946 -173.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -161.91 143.21 10.94 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.617 -0.265 . . . . 74.53 110.547 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -64.66 89.81 0.07 Allowed 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.361 0.6 . . . . 71.45 111.133 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 50.8 p -122.89 134.52 25.09 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 115.91 -0.587 . . . . 65.1 111.127 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_exo -57.4 -20.78 41.75 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.324 2.016 . . . . 61.44 112.376 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -81.42 -42.35 20.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.026 -0.534 . . . . 74.23 111.413 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.54 -21.84 50.53 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.328 -0.463 . . . . 70.12 113.053 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.46 -25.38 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 120.898 0.38 . . . . 54.33 111.377 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 58' ' ' LEU . 3.4 tm? -58.5 -50.76 72.58 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 120.745 0.307 . . . . 75.21 110.452 174.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.432 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -59.92 -41.22 91.27 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.131 0.491 . . . . 70.03 111.032 178.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.71 -51.08 71.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.06 -0.518 . . . . 75.41 111.37 175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -63.37 -43.96 96.13 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.075 -0.511 . . . . 71.5 111.732 -173.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.3 m -66.35 -29.86 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.863 0.363 . . . . 72.33 111.039 177.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.1 t -71.89 -34.64 69.31 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 116.169 -0.469 . . . . 72.03 110.757 173.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -62.93 -43.25 99.3 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.081 -0.508 . . . . 72.4 110.741 175.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.36 -83.22 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.115 -0.493 . . . . 51.31 111.31 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -151.1 -48.74 0.12 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.722 0.296 . . . . 63.44 111.495 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.11 9.11 6.98 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.135 -0.484 . . . . 73.21 111.952 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -95.07 125.3 51.13 Favored Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 116.281 -0.418 . . . . 64.42 110.953 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.81 109.54 0.53 Allowed 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 122.879 2.386 . . . . 71.43 113.198 178.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.497 ' NH1' ' HB2' ' A' ' 37' ' ' ARG . 8.0 mtm105 -104.28 -36.19 7.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.187 -0.46 . . . . 73.4 111.524 -178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 38' ' ' LEU . 8.6 tt -157.22 -33.72 0.08 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.416 0.627 . . . . 75.52 110.726 -175.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.496 ' CD ' ' H ' ' A' ' 39' ' ' GLU . 1.2 pm0 -77.42 60.71 2.1 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 113.27 0.841 . . . . 72.54 113.27 -174.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.726 ' HA ' ' HB3' ' A' ' 5' ' ' PRO . 9.4 pt-20 -75.72 -15.26 60.31 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.501 0.667 . . . . 71.32 110.397 171.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.607 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 33.7 mtp180 -99.88 115.96 30.83 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.322 -0.854 . . . . 65.23 110.916 -176.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -56.22 -27.98 56.75 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 116.245 -0.434 . . . . 72.11 112.084 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -55.73 -43.97 77.06 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.515 0.561 . . . . 74.33 112.515 -179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.573 HG22 ' O ' ' A' ' 41' ' ' ARG . 32.7 m -76.05 -20.62 15.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 112.449 0.537 . . . . 74.42 112.449 -175.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.9 mm -56.0 -47.18 80.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 121.227 0.537 . . . . 72.32 111.031 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -57.05 -38.88 73.87 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 115.849 -0.614 . . . . 60.13 111.31 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.04 -43.7 82.09 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.47 -0.332 . . . . 44.31 111.703 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -50.06 -59.15 4.17 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.484 0.55 . . . . 74.24 112.484 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.533 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 35.3 m -61.7 -42.9 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 112.351 0.5 . . . . 73.11 112.351 -176.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.0 mtp -71.16 -26.3 62.92 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.811 0.339 . . . . 74.42 111.699 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.4 t -95.41 3.38 54.37 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.206 0.447 . . . . 54.4 112.206 -178.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -132.74 -66.88 0.66 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 111.986 0.365 . . . . 73.01 111.986 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 86.4 m-85 -72.03 145.98 47.94 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.224 0.535 . . . . 74.24 111.983 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.2 t -106.77 -8.5 16.77 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.989 -0.551 . . . . 64.31 110.378 171.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.92 108.28 2.97 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.692 -0.686 . . . . 73.2 111.326 -179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -55.07 -39.06 68.84 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.009 0.374 . . . . 72.42 112.009 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -64.1 -41.76 97.15 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 112.004 0.372 . . . . 75.24 112.004 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 25' ' ' LEU . 67.3 mt -69.44 -42.41 74.99 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.136 0.494 . . . . 73.11 111.116 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.3 mt -65.97 -55.92 17.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 116.315 -0.402 . . . . 74.44 111.484 178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.467 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 35.0 tt0 -54.83 -43.81 73.33 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.036 0.384 . . . . 73.34 112.036 -175.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 86.8 m -56.99 -38.5 73.14 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 120.956 0.407 . . . . 61.44 111.255 177.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.468 ' OG1' HG11 ' A' ' 49' ' ' VAL . 96.4 m -66.79 -55.75 13.52 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.353 0.501 . . . . 74.41 112.353 -177.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.467 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 2.7 p-10 -61.49 -35.88 78.92 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.814 0.34 . . . . 72.14 110.745 178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.44 ' O ' HD23 ' A' ' 68' ' ' LEU . 3.5 tmt_? -61.23 -40.96 95.97 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.225 -0.443 . . . . 75.43 110.436 175.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -68.28 -63.24 1.1 Allowed 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.78 0.324 . . . . 72.22 111.782 178.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.4 mm -56.47 -48.82 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.717 0.636 . . . . 75.15 112.717 -176.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 t -62.81 -51.54 66.67 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 111.842 0.312 . . . . 71.4 111.842 -176.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.44 HD23 ' O ' ' A' ' 64' ' ' ARG . 4.2 mm? -67.06 -30.29 70.3 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 111.569 0.211 . . . . 64.31 111.569 179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -61.26 -53.28 58.85 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.901 0.381 . . . . 75.15 111.098 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 20.9 ptp -69.11 -35.88 76.93 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 73.45 111.415 178.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.42 -37.96 89.37 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.124 0.487 . . . . 72.5 111.264 178.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.31 -48.92 60.1 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.306 -0.406 . . . . 73.34 110.498 175.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.415 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -51.09 -42.78 60.84 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.278 -0.419 . . . . 72.33 110.997 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -51.84 -59.96 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.702 0.287 . . . . 72.43 110.695 178.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -74.9 -15.91 60.69 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.085 0.402 . . . . 64.44 112.085 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -75.6 -31.05 59.79 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.284 0.564 . . . . 74.14 110.425 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -93.48 -23.86 18.22 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.768 -0.651 . . . . 73.21 111.069 173.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.44 111.61 2.4 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.287 -0.415 . . . . 73.45 110.901 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 58.64 62.52 1.92 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 121.262 0.553 . . . . 71.45 110.711 -175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.3 t-80 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.407 -0.806 . . . . 55.03 111.333 -179.716 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.587 0.232 . . . . 62.22 111.081 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.41 150.17 21.38 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.806 0.336 . . . . 42.41 111.252 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -97.45 -175.07 34.2 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 121.055 -0.593 . . . . 74.52 114.295 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 34.8 t70 62.02 111.08 0.03 OUTLIER Pre-proline 0 N--CA 1.476 0.831 0 C-N-CA 123.955 0.902 . . . . 71.52 113.241 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.598 ' HD2' HG23 ' A' ' 7' ' ' THR . 4.6 Cg_exo -79.41 38.66 0.75 Allowed 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 123.101 2.534 . . . . 74.22 112.801 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 84.4 mtp 62.15 34.02 16.53 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 111.924 0.342 . . . . 73.44 111.924 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 5' ' ' PRO . 61.8 p -52.91 -54.78 29.7 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 113.018 0.747 . . . . 73.53 113.018 -174.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -58.9 -51.54 69.61 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 120.881 0.372 . . . . 74.51 111.914 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.603 ' O ' ' HG3' ' A' ' 13' ' ' MET . 58.2 t80 -62.48 -36.18 81.69 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 116.461 -0.336 . . . . 73.43 111.341 -178.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -50.43 -45.92 56.17 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 120.995 0.426 . . . . 51.35 111.767 178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -65.69 -47.02 76.87 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 112.124 0.416 . . . . 65.22 112.124 -177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.636 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.2 tp -72.9 -18.11 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.788 0.662 . . . . 73.02 112.788 -172.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.603 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 58.4 mtm -55.38 -39.65 70.39 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.417 0.525 . . . . 65.11 112.417 -178.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.75 -37.52 90.2 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 121.284 -0.484 . . . . 54.14 112.973 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -71.03 -14.63 62.4 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 122.65 -0.324 . . . . 72.25 111.613 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 26' ' ' ALA . 8.3 tp-100 -80.83 -28.53 36.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.76 -0.2 . . . . 73.01 111.438 177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -57.83 -54.98 40.8 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.919 0.39 . . . . 72.21 110.532 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -82.59 120.22 25.25 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.326 -0.397 . . . . 72.44 110.558 172.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -63.12 81.7 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.632 0.73 . . . . 74.4 111.94 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.469 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 81.5 p -116.94 166.06 13.85 Favored Pre-proline 0 N--CA 1.473 0.691 0 CA-C-N 115.53 -0.759 . . . . 70.51 111.369 -177.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.469 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 14.5 Cg_endo -56.78 -29.03 79.3 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 122.18 1.92 . . . . 53.14 111.767 171.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -67.63 -39.7 84.64 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.162 0.506 . . . . 74.33 110.413 173.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.52 -32.63 83.86 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.123 -0.56 . . . . 54.42 112.776 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -57.85 -37.96 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 120.862 0.363 . . . . 63.24 111.0 176.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.59 -55.27 37.2 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 109.915 -0.402 . . . . 74.33 109.915 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.636 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.64 -32.82 69.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.201 0.524 . . . . 74.54 111.77 178.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -68.6 -53.61 21.66 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.965 -0.561 . . . . 64.13 110.597 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.45 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 48.9 t-80 -68.41 -36.45 79.11 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.402 0.519 . . . . 72.53 112.402 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.41 -25.41 35.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.796 -0.565 . . . . 74.12 111.113 177.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.0 t -76.2 -17.32 59.58 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.328 -0.396 . . . . 73.13 111.211 175.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 2.4 tm-20 -67.17 -35.07 78.88 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.274 -0.421 . . . . 72.31 110.712 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -81.07 171.23 15.21 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.047 0.451 . . . . 75.23 111.01 177.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 96.5 mttt -64.34 -32.04 73.48 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.379 -0.373 . . . . 73.04 111.712 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 61.5 31.86 18.9 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.574 0.583 . . . . 73.34 112.574 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 27.8 m-85 -86.99 146.08 39.8 Favored Pre-proline 0 N--CA 1.471 0.578 0 O-C-N 122.298 -0.251 . . . . 75.34 111.371 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -65.36 99.7 0.37 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.224 1.949 . . . . 63.12 112.708 179.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 37' ' ' ARG . 17.5 mtp180 -92.47 -75.04 0.5 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.971 -0.559 . . . . 71.13 110.596 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.58 13.15 8.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.114 0.483 . . . . 63.44 110.598 176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.6 mp0 -88.53 24.55 1.92 Allowed 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.66 0.615 . . . . 72.1 112.66 -171.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.679 ' HG3' ' HG2' ' A' ' 41' ' ' ARG . 10.4 pt-20 -57.07 -26.12 59.86 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.245 0.545 . . . . 71.35 111.712 178.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.679 ' HG2' ' HG3' ' A' ' 40' ' ' GLU . 9.8 mmt180 -110.85 125.39 53.56 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.105 -0.498 . . . . 72.43 110.337 178.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -62.43 -15.55 50.05 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 121.988 -0.445 . . . . 52.21 111.508 177.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -59.14 -51.97 67.72 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 116.079 -0.51 . . . . 74.23 111.59 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.569 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.0 m -65.02 -26.99 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 N-CA-C 112.087 0.402 . . . . 64.4 112.087 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 39' ' ' GLU . 44.0 mm -54.63 -42.51 61.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 121.276 0.56 . . . . 63.51 110.87 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 46' ' ' ARG . 18.6 ttt180 -66.66 -16.88 64.52 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.658 -0.701 . . . . 72.12 111.509 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.65 -44.76 8.41 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.015 0.376 . . . . 71.05 112.015 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -49.74 -44.82 48.75 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.545 0.572 . . . . 74.43 112.545 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.442 ' HB ' ' HA ' ' A' ' 59' ' ' ILE . 30.0 m -56.74 -33.78 41.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 112.338 0.496 . . . . 75.24 112.338 -178.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -75.48 -12.95 60.34 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.84 0.352 . . . . 73.11 111.915 -179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.3 t -107.4 -28.74 9.66 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.942 0.401 . . . . 70.3 112.071 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -94.99 -28.54 15.08 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.259 0.466 . . . . 75.23 112.259 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -119.86 161.82 20.17 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.99 0.424 . . . . 74.14 111.958 -177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.7 p -119.84 -32.29 4.28 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.296 -0.411 . . . . 74.34 111.953 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -74.52 145.09 43.78 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 121.212 0.529 . . . . 70.24 111.603 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -66.94 -35.52 80.17 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.214 0.45 . . . . 74.2 112.214 -176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -68.92 -13.1 62.23 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.099 0.407 . . . . 72.44 112.099 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.6 mt -97.93 -39.6 8.89 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.114 0.483 . . . . 64.3 110.977 174.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.442 ' HA ' ' HB ' ' A' ' 49' ' ' VAL . 64.7 mt -82.53 -62.32 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.369 0.604 . . . . 74.42 111.88 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 63' ' ' ASN . 33.0 tt0 -63.58 -31.44 72.61 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.731 -0.668 . . . . 63.3 112.657 -171.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 70.7 m -56.64 -50.78 71.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.056 0.455 . . . . 72.33 110.71 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 51.8 m -65.86 -42.0 90.96 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.193 -0.458 . . . . 74.21 110.677 176.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 60' ' ' GLU . 7.1 t30 -51.78 -42.46 62.44 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 116.084 -0.507 . . . . 71.33 111.38 176.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -73.19 -47.79 40.69 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.977 -0.556 . . . . 73.14 111.47 178.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.13 -47.29 78.43 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.18 0.437 . . . . 71.12 112.18 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 48.3 mm -59.33 -43.23 89.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-O 120.793 0.33 . . . . 74.2 111.327 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.3 m -56.7 -48.38 77.82 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.138 0.494 . . . . 64.12 110.842 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.9 mt -58.34 -47.11 84.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.739 -0.664 . . . . 74.42 111.759 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -64.02 -35.74 81.69 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.935 0.346 . . . . 62.35 111.935 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 60.2 mtt -65.14 -48.78 72.34 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.839 0.352 . . . . 75.1 111.177 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.24 -34.06 76.65 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.025 0.441 . . . . 74.13 111.605 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -66.18 -55.34 16.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.9 -0.591 . . . . 72.12 110.575 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.24 -44.46 79.67 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.319 -0.4 . . . . 64.12 110.591 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.85 -61.88 2.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.254 -0.43 . . . . 62.22 111.728 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 78' ' ' HIS . 45.2 t-80 -66.27 -32.15 73.4 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 122.234 -0.291 . . . . 72.32 111.693 -177.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -62.67 -37.96 88.45 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.224 0.535 . . . . 74.42 110.599 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -81.51 -27.95 34.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.982 -0.554 . . . . 73.13 110.484 174.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.41 ' HB3' ' HA ' ' A' ' 75' ' ' HIS . 11.6 t60 -85.59 77.1 9.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.021 -0.536 . . . . 75.34 110.224 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -60.78 -54.19 48.21 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.088 0.403 . . . . 44.24 112.088 -174.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.3 t60 . . . . . 0 C--O 1.251 1.167 0 CA-C-O 118.615 -0.707 . . . . 71.31 111.389 178.685 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.8 mmm . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.999 0.428 . . . . 62.0 111.0 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.8 87.49 0.59 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 116.247 -0.433 . . . . 74.03 110.732 179.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.26 -59.99 3.18 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.149 -0.548 . . . . 70.53 112.57 -175.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 53.81 75.61 0.61 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 123.259 0.624 . . . . 74.51 112.292 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.458 ' HG3' ' HA ' ' A' ' 40' ' ' GLU . 34.4 Cg_endo -65.03 -51.77 1.47 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.466 2.111 . . . . 51.45 112.542 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.2 mtt 55.16 23.72 5.6 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.685 0.624 . . . . 74.33 112.685 178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 75.4 p -57.77 -58.96 6.07 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.81 0.3 . . . . 73.14 111.81 -179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -50.59 -43.8 56.69 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.212 0.529 . . . . 75.33 111.392 176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.606 ' O ' ' HG3' ' A' ' 13' ' ' MET . 82.8 t80 -58.89 -48.29 81.95 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.832 -0.622 . . . . 62.54 111.225 177.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.48 -38.8 81.77 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.313 -0.403 . . . . 72.21 111.489 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.404 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 77.3 t80 -65.85 -52.64 48.68 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.308 -0.406 . . . . 72.03 111.997 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.532 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -68.28 -26.13 33.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 N-CA-C 113.167 0.803 . . . . 74.25 113.167 -171.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 60.9 mtm -53.53 -34.99 60.19 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.511 0.56 . . . . 62.34 112.511 -177.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.09 -29.04 67.42 Favored Glycine 0 CA--C 1.529 0.953 0 C-N-CA 121.148 -0.548 . . . . 53.31 113.712 -178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -91.07 -4.5 56.25 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.762 0.315 . . . . 73.21 111.783 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -81.67 -11.62 59.0 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.119 0.485 . . . . 75.21 110.704 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -55.0 -31.87 61.36 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 112.293 0.479 . . . . 64.51 112.293 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -127.43 169.91 13.11 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.279 0.561 . . . . 54.12 112.16 -179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -66.74 90.18 0.17 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 115.831 -0.622 . . . . 72.51 110.953 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.7 p -135.35 154.21 78.46 Favored Pre-proline 0 N--CA 1.472 0.639 0 CA-C-N 116.083 -0.508 . . . . 73.54 110.858 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -52.8 -35.45 69.65 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 122.195 1.93 . . . . 63.22 111.707 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -63.79 -39.46 94.29 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.778 -0.646 . . . . 54.41 111.024 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.68 -40.8 99.63 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 121.192 -0.527 . . . . 65.11 112.549 176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -64.89 -37.97 81.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-O 121.105 0.479 . . . . 72.15 110.669 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.86 -54.6 43.15 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.249 -0.432 . . . . 74.44 110.188 174.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.532 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.86 -47.24 71.2 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.077 0.465 . . . . 72.23 111.803 178.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -53.67 -46.96 70.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.808 -0.633 . . . . 74.43 111.871 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -73.23 -47.6 42.0 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.266 -0.425 . . . . 61.41 112.058 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 27.5 m -66.4 -28.19 42.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 120.897 0.38 . . . . 65.33 111.707 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.96 -21.58 65.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.057 0.456 . . . . 55.4 111.156 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -99.82 -68.2 0.82 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.199 -0.455 . . . . 45.42 111.111 -178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 66.22 169.28 0.22 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.017 0.527 . . . . 73.04 111.875 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.544 ' HD3' ' HE2' ' A' ' 35' ' ' PHE . 84.2 tttt -82.84 7.17 15.98 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.357 0.599 . . . . 73.2 110.507 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 71.65 61.77 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.849 0.86 . . . . 54.4 112.289 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.544 ' HE2' ' HD3' ' A' ' 33' ' ' LYS . 36.9 m-85 -123.03 130.61 24.53 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 116.285 -0.416 . . . . 73.54 111.512 175.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -86.24 103.16 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 122.238 1.958 . . . . 55.51 111.914 171.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.66 -2.72 47.52 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.089 0.403 . . . . 75.2 112.089 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 68.1 mt 63.09 97.16 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.831 0 CA-C-O 121.217 0.532 . . . . 64.21 109.913 -172.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -132.98 47.56 2.49 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.476 0.655 . . . . 73.13 111.996 -166.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' HA ' ' HG3' ' A' ' 5' ' ' PRO . 8.4 mp0 -71.0 -49.57 43.73 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.83 -0.623 . . . . 74.14 110.521 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.581 ' O ' HG22 ' A' ' 44' ' ' VAL . 9.7 mmt180 -87.5 118.09 26.73 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.8 -0.636 . . . . 73.54 111.472 178.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.623 ' HB3' HG23 ' A' ' 66' ' ' ILE . 57.0 m80 -44.78 -38.58 4.58 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 113.335 0.865 . . . . 72.43 113.335 -175.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -51.07 -43.82 61.08 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.724 0.638 . . . . 71.42 112.724 -174.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.5 m -66.83 -31.9 55.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 N-CA-C 112.368 0.507 . . . . 72.3 112.368 -175.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 64.3 mt -56.51 -43.25 77.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 121.239 0.542 . . . . 73.55 110.805 178.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 50' ' ' MET . 59.9 ttp180 -57.03 -39.22 74.39 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.73 -0.668 . . . . 73.42 110.982 175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.1 -33.8 75.19 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.228 0.455 . . . . 61.31 112.228 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -72.98 -51.96 16.28 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.786 0.327 . . . . 73.34 111.644 -179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.7 m -57.52 -38.14 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 N-CA-C 112.133 0.42 . . . . 64.53 112.133 -178.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 60.7 mtm -70.21 -20.48 63.09 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.887 0.375 . . . . 41.03 111.939 178.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.7 t -76.53 -42.16 44.1 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.895 0.379 . . . . 73.3 111.934 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.44 ' N ' HD22 ' A' ' 52' ' ' ASN . 0.9 OUTLIER -94.42 -49.18 5.8 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 113.168 0.803 . . . . 45.31 113.168 -176.516 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -97.83 118.95 35.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.807 0.669 . . . . 70.01 112.807 -169.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.2 p -97.87 78.66 2.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.159 0.504 . . . . 64.11 111.042 175.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.467 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -157.11 127.35 6.41 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.352 -0.385 . . . . 61.31 111.093 -179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t-80 -62.96 -39.4 94.56 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.604 0.594 . . . . 74.34 112.604 -177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -65.91 -45.73 80.87 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 120.937 0.399 . . . . 64.1 111.389 -175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.0 mt -62.57 -51.69 66.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.323 -0.398 . . . . 64.04 111.252 176.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.1 mm -60.65 -41.29 87.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 CA-C-O 120.868 0.366 . . . . 74.35 111.46 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -62.25 -53.3 57.23 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.084 0.468 . . . . 73.12 111.058 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.0 m -53.93 -41.07 67.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.163 -0.471 . . . . 74.01 111.069 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.421 ' O ' HG12 ' A' ' 66' ' ' ILE . 85.2 m -67.06 -64.91 0.76 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.011 -0.541 . . . . 74.33 112.353 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -26.76 65.06 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.227 0.455 . . . . 53.13 112.227 -173.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.8 ttt180 -61.7 -58.83 6.5 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.733 0.302 . . . . 73.12 111.303 177.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.37 -37.05 85.79 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.098 0.475 . . . . 72.54 111.396 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.623 HG23 ' HB3' ' A' ' 42' ' ' HIS . 32.4 mm -56.72 -52.03 59.42 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 CA-C-N 115.954 -0.566 . . . . 71.53 111.732 177.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.8 t -72.07 -49.87 33.0 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 116.305 -0.407 . . . . 64.51 111.85 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -38.79 64.3 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.794 0.665 . . . . 64.21 112.794 -175.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 1.6 m-85 -55.55 -54.64 41.54 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.965 0.412 . . . . 63.41 111.77 177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.2 mtp -78.19 -23.45 47.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.838 0.351 . . . . 72.23 111.874 -176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.88 -43.59 62.33 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.993 0.425 . . . . 61.15 111.295 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.02 -17.95 38.73 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 120.894 0.378 . . . . 65.01 110.861 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 2.7 tm? -52.51 -58.86 5.42 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.641 -0.254 . . . . 72.11 110.939 179.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 77' ' ' HIS . 16.0 tp10 -62.58 -28.94 70.23 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.643 0.259 . . . . 74.43 111.251 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 -60.14 -42.11 94.14 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.915 0.388 . . . . 74.41 110.866 175.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -73.98 -44.76 53.64 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.021 0.439 . . . . 71.31 110.983 174.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 74' ' ' GLU . 56.4 t-80 -61.0 -27.46 68.32 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.874 -0.603 . . . . 75.21 111.766 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -78.69 -25.84 44.83 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 120.91 0.386 . . . . 65.44 110.978 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 66.5 m80 61.99 -178.38 0.13 Allowed 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.891 -0.595 . . . . 72.1 112.602 176.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.252 1.221 0 CA-C-O 118.342 -0.837 . . . . 75.22 111.414 176.983 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.781 0.324 . . . . 72.11 111.66 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.43 80.18 1.04 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.336 0.589 . . . . 72.23 111.81 -178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.477 ' HA3' ' HG ' ' A' ' 38' ' ' LEU . . . -100.94 37.5 3.57 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-N 116.085 -0.507 . . . . 54.33 112.809 178.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.466 ' N ' ' CD ' ' A' ' 5' ' ' PRO . 13.5 m-20 -128.29 33.05 0.23 Allowed Pre-proline 0 CA--C 1.553 1.081 0 N-CA-C 113.969 1.1 . . . . 75.43 113.969 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' CD ' ' N ' ' A' ' 4' ' ' ASP . 38.7 Cg_endo -66.27 -51.41 1.11 Allowed 'Trans proline' 0 C--N 1.363 1.332 0 CA-C-N 120.951 1.375 . . . . 62.34 111.67 175.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 91.6 mmm 57.34 8.57 0.61 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.816 1.043 . . . . 74.14 113.816 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.5 p -56.71 -54.93 40.47 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.133 0.492 . . . . 54.03 111.48 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -52.89 -44.37 66.84 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.814 -0.63 . . . . 74.32 112.183 178.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.543 ' O ' ' HG3' ' A' ' 13' ' ' MET . 23.0 t80 -66.84 -46.54 74.77 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 122.255 -0.278 . . . . 72.31 110.715 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.54 -32.15 62.71 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 120.88 0.371 . . . . 75.22 110.973 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -65.01 -41.21 95.55 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 116.29 -0.413 . . . . 72.21 111.653 176.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.477 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.4 tp -86.8 -12.0 10.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 121.129 0.49 . . . . 72.14 111.515 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.543 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 86.4 mtp -71.62 12.92 0.3 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 113.064 0.764 . . . . 55.41 113.064 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -100.45 -4.31 54.97 Favored Glycine 0 CA--C 1.526 0.762 0 C-N-CA 120.732 -0.747 . . . . 62.12 112.811 173.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -107.66 -20.05 13.35 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.57 0.952 . . . . 73.0 113.57 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.83 -30.39 70.57 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 121.79 -0.569 . . . . 74.31 111.816 -175.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -70.24 -10.84 60.11 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.153 0.501 . . . . 64.13 111.34 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -117.84 143.87 45.9 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.344 -0.389 . . . . 73.32 111.015 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -70.07 84.74 0.53 Allowed 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.203 0.525 . . . . 70.02 111.002 178.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.3 p -136.17 149.49 68.25 Favored Pre-proline 0 N--CA 1.471 0.621 0 CA-C-N 116.088 -0.505 . . . . 71.14 111.376 -177.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_exo -53.15 -30.85 52.24 Favored 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.431 2.087 . . . . 72.21 112.465 174.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.476 ' HB3' HD11 ' A' ' 12' ' ' ILE . 94.1 m-85 -68.02 -38.55 82.7 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.163 -0.472 . . . . 64.52 110.777 175.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.21 -37.56 94.19 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.23 -0.51 . . . . 71.2 112.464 175.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.9 mm -54.92 -46.97 76.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.041 0.448 . . . . 70.11 111.035 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.3 tm? -64.94 -51.12 63.59 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.071 -0.513 . . . . 51.22 110.782 177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.477 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -54.34 -34.3 60.78 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.957 0.408 . . . . 72.34 111.929 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 30' ' ' SER . 35.6 tt0 -75.05 -44.83 45.47 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.376 -0.375 . . . . 74.24 111.419 177.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -63.88 -44.06 94.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.041 0.385 . . . . 64.11 112.041 -177.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.6 m -62.01 -24.03 33.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.985 0.421 . . . . 74.4 111.349 178.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.42 ' HB3' ' O ' ' A' ' 27' ' ' GLU . 48.5 t -65.74 -29.87 70.45 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.085 0.469 . . . . 31.45 110.644 173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -74.88 -48.56 24.24 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.121 -0.491 . . . . 73.33 111.069 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 62.6 m-20 -71.15 -13.54 61.98 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.882 0.372 . . . . 71.13 111.702 177.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -57.26 -18.35 15.94 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-O 121.028 0.442 . . . . 72.03 111.594 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.44 -25.04 33.89 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 112.481 0.548 . . . . 60.45 112.481 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -111.13 98.97 41.49 Favored Pre-proline 0 N--CA 1.47 0.527 0 C-N-CA 122.243 0.217 . . . . 72.42 111.503 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.16 109.01 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.578 2.185 . . . . 64.13 112.292 176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 39' ' ' GLU . 27.6 mtp85 -85.66 -33.64 21.53 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.641 0.608 . . . . 63.4 112.641 -176.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.477 ' HG ' ' HA3' ' A' ' 3' ' ' GLY . 8.4 mp 61.66 36.96 16.32 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 111.743 0.275 . . . . 53.22 111.743 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 37' ' ' ARG . 13.2 mm-40 -48.25 -33.51 8.81 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.159 0.8 . . . . 63.12 113.159 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 73.09 -46.61 0.65 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.377 0.671 . . . . 74.04 111.979 -176.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -82.4 174.79 10.78 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 120.805 0.336 . . . . 73.31 111.226 -178.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -106.59 -55.39 2.33 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.48 0.548 . . . . 74.44 112.48 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.456 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 23.4 tt0 -75.07 -15.12 60.64 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 112.439 0.533 . . . . 61.11 112.439 -170.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.6 m -51.89 -36.42 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.844 0.354 . . . . 53.5 111.866 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 62.1 mt -54.36 -41.48 53.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.129 0.49 . . . . 51.01 111.189 177.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 43' ' ' GLN . 14.4 ttt180 -56.4 -25.14 49.06 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.746 -0.661 . . . . 63.11 112.139 177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -85.39 -48.89 8.58 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.994 0.426 . . . . 72.33 111.487 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -67.72 -37.16 81.84 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.985 0.735 . . . . 54.22 112.985 -175.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.0 m -55.97 -40.65 64.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.975 -0.453 . . . . 71.4 111.751 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.7 mtt -70.78 -28.7 64.86 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 120.926 0.393 . . . . 74.12 111.481 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.6 t -77.26 -31.43 54.94 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.141 0.423 . . . . 72.35 112.141 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -95.07 -59.93 1.79 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 112.338 0.496 . . . . 64.12 112.338 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -78.56 155.94 29.43 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.463 0.649 . . . . 71.13 112.649 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 71.7 p -106.2 -39.22 6.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.718 -0.674 . . . . 63.4 111.29 176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.03 127.45 33.25 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.091 -0.504 . . . . 72.54 111.783 -178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -55.48 -32.52 62.89 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.394 -0.366 . . . . 54.23 111.175 178.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -59.56 -25.54 64.65 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.033 -0.53 . . . . 70.01 112.083 -179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.583 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.6 mt -100.63 -12.46 19.18 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.93 0.395 . . . . 72.51 111.215 177.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 72.1 mt -101.67 -70.52 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-O 121.247 0.546 . . . . 72.12 112.143 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -70.43 -25.86 63.4 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.994 -0.548 . . . . 71.25 112.096 -173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 90.0 m -59.7 -51.34 70.21 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.254 0.549 . . . . 73.42 110.429 171.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.9 m -57.25 -50.23 73.53 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.53 -0.759 . . . . 64.03 110.841 176.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -56.43 -43.92 79.89 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.124 -0.489 . . . . 74.32 111.736 178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.45 -45.22 92.23 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.393 -0.367 . . . . 74.51 110.869 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.95 88.7 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.47 -0.332 . . . . 51.33 111.404 176.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.3 mt -62.56 -45.92 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.133 0.492 . . . . 54.33 111.064 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.8 t -61.44 -39.97 92.76 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.005 -0.543 . . . . 41.15 111.553 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.9 mt -71.68 -40.47 69.56 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.893 0.378 . . . . 63.3 111.171 176.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.0 t80 -55.93 -56.2 23.5 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.311 -0.404 . . . . 62.23 111.613 179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.508 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 25.8 ptm -62.24 -38.91 91.05 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.535 -0.302 . . . . 70.34 111.502 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.55 91.19 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.976 0.417 . . . . 65.04 111.619 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -56.66 -46.69 80.92 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.113 -0.494 . . . . 71.04 110.91 177.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.59 -63.0 1.3 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.163 -0.471 . . . . 72.53 111.525 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 70' ' ' MET . 11.1 pt-20 -53.62 -46.01 70.33 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.768 0.655 . . . . 71.32 112.768 -174.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 29.9 m170 -67.07 -40.85 87.12 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.715 0.293 . . . . 73.51 111.568 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -82.08 1.65 34.96 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.397 0.618 . . . . 73.5 111.487 176.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -100.99 -15.15 17.58 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.294 0.568 . . . . 73.44 109.873 167.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -94.27 -28.21 15.72 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.079 -0.51 . . . . 74.43 110.737 175.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -141.43 -168.17 2.58 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 122.79 0.436 . . . . 71.33 111.391 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.85 -0.595 . . . . 50.13 111.994 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' SD ' ' N ' ' A' ' 1' ' ' MET . 2.8 mpp? . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.518 0.199 . . . . 72.53 110.711 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.8 90.19 3.22 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 120.878 0.371 . . . . 64.51 111.821 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 66.66 -90.88 0.17 Allowed Glycine 0 CA--C 1.528 0.848 0 C-N-CA 121.347 -0.454 . . . . 70.24 113.531 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -110.06 99.77 40.76 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-O 121.264 0.554 . . . . 74.54 111.745 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.55 -51.25 0.1 OUTLIER 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 122.525 2.15 . . . . 75.33 113.261 178.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 57.8 mtt -127.83 82.94 2.12 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.173 0.511 . . . . 64.05 111.843 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.5 p -61.62 -50.35 72.93 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.895 -0.593 . . . . 63.03 111.385 176.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -51.24 -49.27 61.44 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 115.764 -0.653 . . . . 71.15 112.14 178.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -56.08 -46.22 79.09 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.047 0.451 . . . . 55.15 111.712 -178.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -65.68 -22.49 66.63 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 116.365 -0.38 . . . . 62.14 111.982 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -92.46 -48.07 6.83 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.89 0.376 . . . . 74.12 111.892 -179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.9 tp -59.3 -34.62 54.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 N-CA-C 112.381 0.511 . . . . 61.54 112.381 -174.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 68.4 mtm -59.53 -19.33 47.51 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.808 0.337 . . . . 65.43 111.784 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -62.19 -28.29 70.48 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.218 -0.515 . . . . 54.31 112.931 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.34 2.31 52.79 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.56 -0.377 . . . . 74.23 111.611 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.668 ' HG2' ' HG2' ' A' ' 27' ' ' GLU . 24.5 tm0? -89.32 -28.9 19.54 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.589 -0.278 . . . . 65.34 111.138 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -66.02 -65.63 0.65 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.859 0.361 . . . . 74.33 110.33 177.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -88.56 108.99 19.71 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.168 0.509 . . . . 65.23 110.149 171.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -57.12 112.89 1.49 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.749 -0.66 . . . . 71.23 112.644 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 74.9 p -128.73 167.3 19.83 Favored Pre-proline 0 N--CA 1.468 0.443 0 CA-C-N 115.623 -0.717 . . . . 74.11 110.423 177.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.11 -26.54 19.56 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.064 1.843 . . . . 73.34 112.375 172.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -78.43 -33.19 48.72 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.295 0.569 . . . . 44.15 110.748 175.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.97 -27.75 62.64 Favored Glycine 0 CA--C 1.526 0.742 0 CA-C-N 115.824 -0.626 . . . . 63.13 113.225 178.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.2 mm -53.11 -37.51 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.046 0.451 . . . . 74.24 111.408 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -82.43 -39.02 23.18 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.199 -0.455 . . . . 73.41 110.288 176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.468 ' HB1' ' HB2' ' A' ' 16' ' ' GLN . . . -54.96 -43.56 73.58 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.262 -0.427 . . . . 75.43 111.983 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.668 ' HG2' ' HG2' ' A' ' 16' ' ' GLN . 19.2 mt-10 -71.32 -31.13 67.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.153 -0.342 . . . . 72.35 111.242 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -62.12 -50.31 72.42 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 120.794 0.331 . . . . 72.45 111.39 177.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.491 ' O ' ' HB3' ' A' ' 33' ' ' LYS . 35.0 m -65.88 -28.05 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-O 120.716 0.293 . . . . 75.12 111.24 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 33.3 t -72.02 -32.53 67.24 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.223 0.535 . . . . 72.12 111.023 173.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -73.97 -48.78 27.99 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.215 0.531 . . . . 64.12 111.996 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -98.62 19.57 14.45 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-O 121.12 0.486 . . . . 75.11 111.877 -175.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 29' ' ' VAL . 60.6 pttt -65.68 -10.65 38.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.904 0.705 . . . . 72.34 112.904 -177.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.91 11.06 1.9 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.801 0.667 . . . . 63.42 112.801 -176.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -109.66 99.21 36.81 Favored Pre-proline 0 CA--C 1.544 0.719 0 O-C-N 121.949 -0.469 . . . . 72.53 110.787 178.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -71.46 101.77 1.19 Allowed 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.515 2.143 . . . . 74.11 112.797 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.46 ' HB3' ' HG3' ' A' ' 39' ' ' GLU . 71.9 mtp85 -88.89 -37.08 15.58 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.09 0.404 . . . . 64.52 112.09 -178.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 9.8 mp 55.38 18.03 2.4 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 113.175 0.805 . . . . 74.34 113.175 177.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' HG3' ' HB3' ' A' ' 37' ' ' ARG . 52.0 mt-10 -62.23 -37.1 84.09 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 111.996 0.369 . . . . 74.52 111.996 -178.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 39' ' ' GLU . 37.1 tt0 72.92 -53.08 0.71 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.15 0.58 . . . . 63.45 112.334 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.459 ' O ' HG22 ' A' ' 44' ' ' VAL . 13.8 mmt85 -67.25 118.55 10.79 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.102 0.477 . . . . 71.22 111.449 -178.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -85.29 -24.63 27.64 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.31 0.485 . . . . 75.14 112.31 -172.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' OE1' HG13 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -62.06 -33.64 74.77 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 112.421 0.526 . . . . 72.01 112.421 -179.285 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 41' ' ' ARG . 34.2 m -68.32 -31.26 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 120.8 0.334 . . . . 64.32 111.488 178.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.0 mt -65.49 -41.61 91.34 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 120.963 0.411 . . . . 71.32 110.966 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.427 ' HB2' HG21 ' A' ' 66' ' ' ILE . 3.5 tmt_? -55.6 -40.16 71.68 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.113 -0.494 . . . . 75.31 111.201 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.453 ' HA ' ' HE2' ' A' ' 50' ' ' MET . . . -75.54 -46.65 30.84 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.992 0.425 . . . . 75.13 111.121 177.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -53.24 -48.33 68.29 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 116.181 -0.463 . . . . 61.42 112.074 -178.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.611 HG11 HG21 ' A' ' 62' ' ' THR . 35.8 m -60.35 -34.61 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.028 0.381 . . . . 62.1 112.028 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.453 ' HE2' ' HA ' ' A' ' 47' ' ' ALA . 53.1 mtm -74.04 -28.73 61.56 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.982 0.42 . . . . 74.51 111.391 179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 43.4 t -78.48 -30.36 47.28 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 116.157 -0.474 . . . . 74.22 112.097 -179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -109.82 -45.6 3.62 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.069 0.766 . . . . 54.01 113.069 -173.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' O ' ' A' ' 49' ' ' VAL . 37.7 m-85 -76.29 151.19 36.82 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.487 0.66 . . . . 73.44 112.449 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 52.7 p -105.84 -55.41 2.33 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.794 -0.639 . . . . 74.04 111.58 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -55.74 122.94 12.57 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.232 0.539 . . . . 43.14 112.073 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -67.89 -23.91 65.16 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.367 -0.378 . . . . 72.1 111.268 178.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -68.43 -12.99 61.98 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.005 0.431 . . . . 50.42 111.262 173.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.65 -47.4 5.35 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.25 0.548 . . . . 51.33 110.141 172.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.1 mt -66.48 -63.24 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 115.857 -0.61 . . . . 74.21 112.264 -179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -63.75 -22.57 66.98 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.394 0.516 . . . . 74.02 112.394 -174.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 83.5 m -72.69 -47.74 44.77 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.158 0.504 . . . . 74.44 110.886 173.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.611 HG21 HG11 ' A' ' 49' ' ' VAL . 88.5 m -63.94 -53.96 42.1 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.183 -0.462 . . . . 65.45 112.007 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -65.21 -27.96 69.04 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.0 0.37 . . . . 64.2 112.0 -177.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 32.5 tpt180 -56.04 -59.71 4.52 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.925 0.393 . . . . 72.25 111.105 174.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.72 -45.22 94.89 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.346 -0.388 . . . . 72.33 111.848 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG21 ' HB2' ' A' ' 46' ' ' ARG . 55.6 mt -61.28 -41.24 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 111.792 0.293 . . . . 73.23 111.792 -178.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 79.0 p -66.28 -36.47 83.06 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 120.804 0.335 . . . . 71.24 111.068 176.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 96.1 mt -61.94 -39.58 92.59 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.906 0.384 . . . . 75.21 110.783 174.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -73.49 9.61 1.31 Allowed 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.805 0.336 . . . . 65.41 111.818 175.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 62.2 mtt -113.87 -61.01 1.81 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 121.035 0.445 . . . . 73.02 110.281 170.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.02 -52.92 63.66 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.111 -0.495 . . . . 75.13 112.056 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 -67.74 -42.59 81.62 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.871 0.367 . . . . 73.32 110.498 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -51.01 -49.36 60.6 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.318 -0.401 . . . . 52.25 110.66 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.33 -24.59 66.55 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.489 0.551 . . . . 71.4 112.489 178.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.8 m170 -74.9 -18.58 60.39 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.793 0.33 . . . . 64.42 111.658 177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -100.38 -33.83 10.21 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.112 0.482 . . . . 65.24 110.764 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 61.0 t60 -72.6 -29.16 63.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.855 -0.611 . . . . 74.31 111.178 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -103.15 80.08 1.81 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 109.205 -0.665 . . . . 61.24 109.205 170.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -64.89 -49.2 71.41 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.116 -0.493 . . . . 74.33 111.15 -174.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-N 116.57 -0.287 . . . . 52.43 111.471 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.454 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.2 mpp? . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 120.754 0.311 . . . . 71.44 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.07 97.13 3.35 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.898 0.38 . . . . 74.43 111.77 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -100.81 40.98 2.25 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 121.315 -0.469 . . . . 73.44 112.532 177.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.469 ' HB3' ' HA ' ' A' ' 38' ' ' LEU . 0.9 OUTLIER -150.67 61.77 4.88 Favored Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 112.389 0.514 . . . . 74.24 112.389 -176.412 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -70.25 11.03 0.48 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 122.62 2.214 . . . . 74.22 113.855 179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 26.9 mmt 56.55 45.27 22.62 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.618 0.599 . . . . 73.42 112.618 175.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.1 p -53.05 -38.69 62.66 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.885 0.374 . . . . 74.34 111.832 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -64.02 -44.84 91.36 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.96 0.41 . . . . 74.34 111.747 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.515 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 86.3 t80 -57.83 -37.51 73.98 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.344 -0.389 . . . . 74.2 111.919 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -51.5 -31.41 23.68 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.176 0.436 . . . . 72.23 112.176 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -88.43 -54.17 4.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 120.806 0.336 . . . . 74.3 111.627 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.8 tp -68.26 -21.79 26.86 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 N-CA-C 112.697 0.629 . . . . 72.04 112.697 -174.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.444 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.04 -20.14 50.44 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.255 0.465 . . . . 73.11 112.255 -178.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.53 -18.65 51.97 Favored Glycine 0 CA--C 1.527 0.831 0 CA-C-N 116.359 -0.382 . . . . 62.13 113.547 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -95.5 -11.66 27.11 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 122.421 -0.458 . . . . 74.13 111.86 176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.442 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 0.0 OUTLIER -88.11 -34.57 17.86 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.575 0.213 . . . . 72.52 111.575 -177.002 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -52.67 -69.36 0.12 Allowed 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.133 0.492 . . . . 64.14 111.263 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -89.13 115.02 26.35 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 108.845 -0.798 . . . . 72.42 108.845 172.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.583 HD22 ' N ' ' A' ' 19' ' ' ASN . 0.8 OUTLIER -58.18 110.99 1.05 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 113.587 0.958 . . . . 70.55 113.587 -164.36 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 66.7 p -123.2 157.46 60.99 Favored Pre-proline 0 N--CA 1.471 0.625 0 CA-C-N 115.386 -0.825 . . . . 45.03 110.141 174.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -52.65 -32.79 56.22 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.341 2.027 . . . . 55.23 112.443 176.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -76.01 -28.63 57.85 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.122 0.487 . . . . 52.5 110.903 177.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.61 -25.96 66.05 Favored Glycine 0 CA--C 1.523 0.563 0 CA-C-N 116.06 -0.518 . . . . 31.32 113.119 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.0 mm -62.11 -33.54 59.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-O 120.902 0.382 . . . . 75.24 110.878 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.79 -49.84 69.13 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 109.629 -0.508 . . . . 74.01 109.629 174.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.511 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.39 -37.93 79.23 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 116.116 -0.493 . . . . 74.43 111.433 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -62.78 -49.06 76.48 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.158 0.504 . . . . 72.22 110.922 174.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -59.69 -51.02 71.57 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 53.24 111.277 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.593 ' HA ' ' HB2' ' A' ' 32' ' ' ASP . 28.0 m -61.15 -26.31 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-O 120.884 0.373 . . . . 73.04 111.576 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.8 t -63.95 -40.14 95.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 121.094 0.473 . . . . 71.02 110.251 172.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -72.6 -36.6 68.16 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.152 0.501 . . . . 70.14 110.37 174.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.593 ' HB2' ' HA ' ' A' ' 29' ' ' VAL . 11.0 m-20 -59.84 -30.89 69.26 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.179 -0.464 . . . . 72.23 111.437 175.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.401 ' HE2' ' OD1' ' A' ' 4' ' ' ASP . 22.9 tptp -60.07 -39.78 87.23 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.856 0.36 . . . . 74.33 111.094 173.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.06 -26.55 68.89 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 121.278 0.561 . . . . 74.54 111.057 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -92.23 135.11 27.32 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.367 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -56.06 84.79 0.04 OUTLIER 'Trans proline' 0 CA--C 1.545 1.046 0 C-N-CA 122.528 2.152 . . . . 61.3 114.005 179.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.589 ' HD3' ' HB3' ' A' ' 32' ' ' ASP . 21.6 mtp180 -108.51 -27.42 9.91 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 116.283 -0.417 . . . . 73.2 111.383 172.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.469 ' HA ' ' HB3' ' A' ' 4' ' ' ASP . 6.1 mp 49.01 72.11 0.32 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 112.55 0.574 . . . . 73.03 112.55 178.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -117.89 99.16 6.74 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.776 0.798 . . . . 73.45 112.162 -177.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -102.45 -24.83 13.79 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.298 -0.865 . . . . 75.12 110.607 175.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 41' ' ' ARG . 3.3 mpt_? -84.44 -171.65 3.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 115.796 -0.638 . . . . 65.31 110.801 178.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.651 ' HB3' HD12 ' A' ' 66' ' ' ILE . 45.8 m80 -125.69 -48.83 1.65 Allowed 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.323 0.49 . . . . 72.22 112.323 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -59.42 -36.7 76.36 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.794 0.33 . . . . 54.31 111.743 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 10.4 p -60.11 -40.78 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-O 120.848 0.356 . . . . 74.1 111.287 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.59 -43.5 96.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 121.132 0.491 . . . . 63.44 110.347 176.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -55.57 -37.42 68.01 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.907 -0.588 . . . . 74.33 110.568 177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.76 -38.51 62.19 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.05 0.452 . . . . 73.21 111.572 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 61.4 t80 -65.61 -42.96 90.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.333 -0.394 . . . . 74.32 111.936 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.524 ' HA ' ' CD1' ' A' ' 53' ' ' TYR . 30.6 m -63.9 -41.18 91.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 N-CA-C 112.171 0.434 . . . . 63.41 112.171 -177.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.445 ' HA ' HD13 ' A' ' 59' ' ' ILE . 66.1 mtm -65.04 -19.48 66.02 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.059 0.457 . . . . 70.32 111.297 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 36.5 t -90.84 -43.11 10.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 112.575 0.583 . . . . 53.15 112.575 -178.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -101.99 -34.57 9.29 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 113.725 1.009 . . . . 64.21 113.725 -171.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.524 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 9.0 m-85 -85.74 130.78 34.47 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.295 0.569 . . . . 75.53 111.559 -174.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.452 HG23 ' H ' ' A' ' 55' ' ' ASP . 2.0 t -75.85 -59.52 2.72 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 113.479 0.918 . . . . 72.15 113.479 -174.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.452 ' H ' HG23 ' A' ' 54' ' ' THR . 6.1 m-20 -74.69 150.59 39.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.928 0.871 . . . . 72.21 113.333 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -67.97 -35.53 78.53 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.22 -0.9 . . . . 74.44 111.577 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.24 4.89 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.17 0.509 . . . . 61.44 111.884 177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.1 mt -100.28 -46.72 5.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.548 0.69 . . . . 73.55 109.608 168.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.445 HD13 ' HA ' ' A' ' 50' ' ' MET . 64.9 mt -73.88 -61.23 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.362 -0.835 . . . . 71.41 111.875 178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.49 -34.19 66.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.185 0.439 . . . . 73.03 112.185 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 99.3 m -62.45 -43.88 97.75 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.886 0.374 . . . . 75.31 110.781 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' HG12 ' A' ' 66' ' ' ILE . 93.6 m -62.99 -46.85 85.75 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.253 -0.43 . . . . 61.54 110.561 175.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -55.75 -46.74 77.79 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.02 0.438 . . . . 54.43 111.128 176.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 11.7 ttm180 -61.45 -44.96 96.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.165 -0.47 . . . . 73.45 110.723 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.39 88.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.228 -0.442 . . . . 64.01 111.298 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.651 HD12 ' HB3' ' A' ' 42' ' ' HIS . 48.6 mm -63.47 -49.19 83.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.581 -0.282 . . . . 64.41 111.01 176.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 74.6 m -57.57 -48.57 79.0 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.824 0.305 . . . . 72.42 111.824 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 89.1 mt -66.37 -41.89 88.78 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.586 0.231 . . . . 74.32 111.266 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -56.5 -52.59 64.15 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 121.013 0.435 . . . . 53.21 111.082 175.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.456 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 2.1 mmt -62.69 -47.44 83.64 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 116.197 -0.456 . . . . 72.21 111.178 178.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.79 -44.15 90.64 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.849 0.356 . . . . 42.12 111.871 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -69.2 -34.94 75.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.904 0.383 . . . . 74.31 110.914 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 53.6 tp -66.68 -43.83 83.41 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 116.254 -0.43 . . . . 65.33 111.243 176.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' MET . 28.4 mm-40 -65.55 -39.51 91.82 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.537 -0.301 . . . . 73.53 111.005 177.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -60.92 -36.91 80.53 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 120.848 0.356 . . . . 61.22 110.634 172.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -69.59 -13.77 62.49 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 120.802 0.334 . . . . 71.11 111.254 175.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.42 ' O ' ' HB2' ' A' ' 78' ' ' HIS . 48.6 m170 -88.65 -62.42 1.49 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.602 -0.272 . . . . 64.53 111.434 176.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 77' ' ' HIS . 31.7 m80 70.56 -52.62 0.66 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.184 0.594 . . . . 74.2 112.476 -175.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -65.18 107.49 1.58 Allowed 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.326 0.491 . . . . 72.33 112.326 -177.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 C--O 1.252 1.224 0 C-N-CA 123.41 0.684 . . . . 74.32 112.775 177.391 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.427 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.6 mpp? . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.726 0.298 . . . . 72.24 111.226 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.98 148.19 42.32 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.892 0.377 . . . . 65.5 111.909 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -74.47 174.76 49.99 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 120.898 -0.668 . . . . 71.11 112.855 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.452 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 21.0 t70 70.06 116.38 0.03 OUTLIER Pre-proline 0 CA--C 1.545 0.786 0 C-N-CA 122.91 0.484 . . . . 73.31 111.736 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 4' ' ' ASP . 1.7 Cg_endo -85.84 -68.28 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 123.194 2.596 . . . . 62.5 113.847 -178.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.1 mtm 68.07 -36.49 0.31 Allowed 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.562 0.949 . . . . 73.21 113.562 -174.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.0 p -49.45 -41.39 40.02 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.55 0.574 . . . . 73.45 112.55 -179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -52.63 -40.66 63.0 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.173 0.511 . . . . 73.32 111.11 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -75.86 -39.31 56.78 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.962 -0.563 . . . . 73.12 110.753 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -57.2 -32.84 66.89 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 116.404 -0.362 . . . . 71.42 111.539 178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -55.24 -39.09 69.34 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.237 -0.438 . . . . 74.23 111.674 178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.8 tp -103.93 -15.59 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 121.017 0.437 . . . . 73.3 111.916 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 ttp -58.58 144.51 42.64 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.982 0.42 . . . . 70.41 111.18 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.12 -38.84 2.95 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.101 -0.571 . . . . 75.24 112.544 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -75.22 -2.37 27.63 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 122.442 -0.446 . . . . 71.43 112.045 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -75.32 -14.69 60.51 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.763 0.316 . . . . 73.54 111.324 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -62.38 -40.05 95.18 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.947 0.404 . . . . 61.15 111.259 -178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -91.04 -154.57 0.36 Allowed 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 116.307 -0.406 . . . . 71.45 111.2 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -122.14 27.99 7.73 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.56 0.578 . . . . 71.52 112.56 -173.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 136.67 75.3 Favored Pre-proline 0 N--CA 1.475 0.796 0 O-C-N 121.724 -0.61 . . . . 73.32 111.096 174.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.15 -31.86 37.65 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.565 2.177 . . . . 70.12 112.311 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -60.5 -51.46 69.34 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.835 -0.62 . . . . 71.52 110.75 175.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.99 -37.9 95.72 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 121.047 -0.597 . . . . 72.33 112.608 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 51.5 mm -63.37 -39.71 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.98 0.419 . . . . 73.12 111.318 176.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.501 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.35 -40.32 81.88 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.375 -0.375 . . . . 74.2 110.734 177.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.81 -47.59 64.21 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.038 0.447 . . . . 72.4 111.661 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -75.54 -30.08 59.63 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.644 0.259 . . . . 63.11 111.507 177.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -64.04 -39.84 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.62 0.247 . . . . 73.53 111.093 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -77.94 -31.6 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 CA-C-O 121.044 0.449 . . . . 71.43 110.997 175.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 47.7 t -73.72 -9.17 58.38 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.143 0.497 . . . . 62.51 111.218 175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -69.7 -31.82 70.07 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.167 0.508 . . . . 74.25 111.386 176.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -71.12 -173.07 0.78 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.249 -0.432 . . . . 72.14 110.89 -178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -68.19 -4.32 13.55 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.798 -0.564 . . . . 74.25 112.012 -177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.68 19.85 8.4 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 113.201 0.815 . . . . 43.14 113.201 172.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -118.52 104.01 48.15 Favored Pre-proline 0 N--CA 1.47 0.543 0 N-CA-C 111.888 0.329 . . . . 71.44 111.888 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HB3' ' HB2' ' A' ' 39' ' ' GLU . 35.1 Cg_exo -61.53 119.85 7.19 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.551 2.167 . . . . 54.42 112.391 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -89.31 -57.45 2.88 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.856 0.317 . . . . 71.04 111.856 -175.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.5 mt -118.17 4.74 11.96 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.031 0.443 . . . . 64.43 110.991 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HB2' ' HB3' ' A' ' 36' ' ' PRO . 1.6 mp0 -75.63 25.87 0.11 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.052 0.76 . . . . 62.43 113.052 -172.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -61.27 -47.92 83.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.544 0.688 . . . . 61.43 110.793 174.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.568 ' O ' HG22 ' A' ' 44' ' ' VAL . 24.6 mmm180 -91.35 120.77 32.5 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.503 -0.771 . . . . 72.14 110.894 -178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.53 ' HB3' HG23 ' A' ' 66' ' ' ILE . 33.0 m170 -56.2 -20.59 18.75 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 112.317 0.488 . . . . 75.1 112.317 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -62.34 -55.58 26.69 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.908 0.385 . . . . 74.34 111.254 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 41' ' ' ARG . 24.5 m -62.34 -30.67 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 116.483 -0.326 . . . . 72.44 111.32 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.467 HD12 ' HA ' ' A' ' 42' ' ' HIS . 60.3 mt -58.91 -52.44 60.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.023 0.44 . . . . 65.31 110.468 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -57.79 -43.44 85.59 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.202 -0.454 . . . . 73.33 111.521 177.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.95 -52.31 57.02 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.071 0.462 . . . . 74.34 112.04 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 44' ' ' VAL . 36.3 m-85 -67.22 -32.88 74.23 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.134 0.791 . . . . 75.45 113.134 -175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.585 HG11 HG21 ' A' ' 62' ' ' THR . 35.1 m -66.78 -37.18 78.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 120.349 -0.54 . . . . 74.44 110.817 176.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG2' HD13 ' A' ' 59' ' ' ILE . 63.8 mtm -77.37 -20.97 53.97 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.053 0.454 . . . . 70.04 110.974 174.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.423 ' HB3' ' HA ' ' A' ' 48' ' ' TYR . 36.0 t -78.68 -41.33 31.46 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 116.251 -0.431 . . . . 62.14 111.87 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -87.66 -40.76 13.9 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 111.795 0.295 . . . . 42.24 111.795 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.75 176.28 5.36 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.409 0.623 . . . . 73.02 112.195 -177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.7 t -139.97 -34.73 0.54 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.645 -0.707 . . . . 71.13 111.47 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -57.81 118.69 5.58 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.28 0.474 . . . . 62.2 112.28 -178.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -59.14 -32.41 69.83 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.992 -0.549 . . . . 63.44 111.182 178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.6 mm-40 -57.23 -41.01 78.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.162 0.506 . . . . 72.13 111.523 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.501 HD22 HD23 ' A' ' 25' ' ' LEU . 77.4 mt -80.22 -48.82 12.51 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.181 -0.463 . . . . 74.12 111.226 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.4 HD13 ' HG2' ' A' ' 50' ' ' MET . 59.9 mt -61.8 -43.85 97.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.051 -0.522 . . . . 74.44 112.313 -177.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -59.28 -38.69 80.77 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-O 120.541 0.21 . . . . 74.4 111.216 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.7 m -57.7 -59.29 5.43 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.905 0.383 . . . . 64.42 111.709 179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.585 HG21 HG11 ' A' ' 49' ' ' VAL . 61.3 m -58.32 -48.81 79.35 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.103 0.477 . . . . 61.35 111.406 178.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -59.02 -40.55 85.34 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.146 0.498 . . . . 75.2 111.289 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.4 ttt180 -59.56 -48.62 80.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 115.85 -0.614 . . . . 72.22 110.983 178.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.26 -44.48 92.41 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.177 -0.465 . . . . 64.51 111.718 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.53 HG23 ' HB3' ' A' ' 42' ' ' HIS . 80.7 mt -56.52 -59.49 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.349 -0.387 . . . . 72.34 111.849 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.4 m -60.71 -49.99 75.27 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.414 0.524 . . . . 65.11 112.414 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.0 mt -65.89 -43.08 89.33 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -62.94 -41.05 99.38 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.964 0.412 . . . . 74.23 111.37 -178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 76.1 mtp -78.29 -30.0 48.17 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 111.847 0.314 . . . . 71.32 111.847 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.9 -35.2 72.21 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.173 0.511 . . . . 62.14 111.015 174.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -58.82 -42.98 90.46 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.975 -0.557 . . . . 71.02 110.844 177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.03 -49.51 71.38 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.14 -0.482 . . . . 74.03 110.983 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -55.51 -50.52 69.74 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.147 -0.479 . . . . 74.22 112.168 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -71.65 -40.13 69.88 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 120.716 0.294 . . . . 73.04 111.601 -179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -62.36 -20.18 64.13 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 120.914 0.388 . . . . 70.22 111.236 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -63.85 -17.15 62.85 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 115.964 -0.562 . . . . 63.43 111.278 177.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -103.69 125.26 50.07 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.243 0.544 . . . . 74.15 112.406 178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -102.19 -55.39 2.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.254 -1.017 . . . . 62.43 108.254 166.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.7 m-70 . . . . . 0 C--O 1.255 1.372 0 CA-C-N 114.722 -1.127 . . . . 70.34 109.815 170.506 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.388 0.137 . . . . 61.12 110.984 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 53.8 22.9 3.46 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 112.459 0.541 . . . . 63.05 112.459 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 113.74 -42.89 1.82 Allowed Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.43 -0.414 . . . . 74.44 112.82 -176.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.75 117.37 55.09 Favored Pre-proline 0 CA--C 1.543 0.709 0 O-C-N 122.619 -0.342 . . . . 73.04 111.0 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -67.34 -17.35 49.5 Favored 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 122.808 2.339 . . . . 74.14 113.199 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.641 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 54.9 mtm 54.65 52.76 11.64 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.132 0.491 . . . . 73.24 111.567 -179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.3 p -52.99 -57.13 11.38 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.977 -0.556 . . . . 71.5 112.223 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.532 ' HA ' ' OH ' ' A' ' 69' ' ' TYR . 72.9 t80 -62.38 -39.21 92.45 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.256 -0.429 . . . . 64.43 111.891 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 59.6 t80 -61.74 -55.05 34.31 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 120.832 0.349 . . . . 75.03 111.118 -178.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -56.78 -29.08 62.29 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.169 0.509 . . . . 61.32 111.442 178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -76.61 -53.34 8.17 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 61.42 111.806 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.714 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -66.71 -24.57 33.04 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.366 0.506 . . . . 74.44 112.366 -174.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 92.2 mtp -55.91 -27.79 53.78 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 111.924 0.342 . . . . 64.0 111.924 177.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.07 -28.84 73.43 Favored Glycine 0 CA--C 1.53 0.974 0 C-N-CA 121.18 -0.533 . . . . 54.24 112.994 177.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -81.38 -25.46 36.27 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.526 -0.396 . . . . 73.14 111.674 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' HG2' ' HB2' ' A' ' 27' ' ' GLU . 16.5 tp60 -91.34 7.66 39.91 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 121.142 0.496 . . . . 72.12 111.207 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -61.66 -34.65 76.09 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.521 0.677 . . . . 73.4 109.434 172.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -124.59 177.1 6.12 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.313 -0.858 . . . . 64.02 109.961 171.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -80.99 102.92 10.47 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.224 0.535 . . . . 60.12 112.29 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.4 p -134.26 154.87 80.22 Favored Pre-proline 0 N--CA 1.475 0.789 0 CA-C-N 116.118 -0.492 . . . . 63.42 111.257 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -58.67 -33.01 97.99 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 122.476 2.117 . . . . 73.31 112.048 174.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -68.32 -39.81 81.87 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.227 0.537 . . . . 71.54 110.489 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.94 78.59 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 115.86 -0.609 . . . . 52.02 113.124 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.4 mm -50.8 -42.71 23.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-O 120.949 0.404 . . . . 63.33 110.962 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.58 -52.47 65.04 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.952 0.406 . . . . 63.24 110.263 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.714 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -55.9 -50.0 71.89 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.086 -0.506 . . . . 64.3 112.213 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.4 ' HB2' ' HG2' ' A' ' 16' ' ' GLN . 33.4 tt0 -70.66 -38.23 73.78 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.57 -0.286 . . . . 73.1 111.529 -177.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -66.81 -37.87 85.36 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 122.213 -0.304 . . . . 62.34 111.769 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.35 -26.04 21.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-O 120.969 0.414 . . . . 64.23 110.759 176.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -69.31 -36.86 77.41 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.303 0.573 . . . . 60.0 110.379 171.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.83 -35.52 78.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.423 -0.808 . . . . 63.24 111.352 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -67.16 165.25 16.38 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.818 -0.628 . . . . 65.15 112.224 -178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -43.59 -42.7 5.26 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 123.722 0.809 . . . . 72.35 113.143 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 63.63 129.99 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 CA-C-O 121.212 0.53 . . . . 73.02 112.093 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 37' ' ' ARG . 86.1 t80 -155.53 124.86 3.11 Favored Pre-proline 0 CA--C 1.542 0.656 0 O-C-N 122.159 -0.338 . . . . 75.31 111.645 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 35' ' ' PHE . 39.1 Cg_exo -62.19 120.95 8.75 Favored 'Trans proline' 0 CA--C 1.542 0.925 0 C-N-CA 122.837 2.358 . . . . 71.43 112.578 175.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 35' ' ' PHE . 64.9 mtp180 -119.71 -36.0 3.41 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.012 0.375 . . . . 72.4 112.012 -174.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.2 mp 62.43 79.43 0.26 Allowed 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.387 0.675 . . . . 71.11 111.962 -177.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.73 -24.15 33.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.184 -0.462 . . . . 74.24 111.882 177.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 66.84 -72.79 0.08 Allowed 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.564 0.579 . . . . 54.34 112.564 178.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.46 117.51 10.32 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.082 0.468 . . . . 75.13 112.029 -175.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -56.84 -30.55 63.89 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.671 0.619 . . . . 65.13 112.671 -177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -67.24 -48.11 68.77 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 112.924 0.713 . . . . 74.23 112.924 -173.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 27.4 m -63.81 -18.53 22.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 N-CA-C 113.215 0.821 . . . . 54.0 113.215 -173.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 66.5 mt -56.13 -39.4 58.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 N-CA-C 112.372 0.508 . . . . 74.34 112.372 -177.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 63.1 ttp180 -61.37 -32.85 72.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.439 0.533 . . . . 72.54 112.439 -177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.47 -41.55 97.42 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.041 0.448 . . . . 64.34 111.79 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -61.61 -50.15 73.71 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.302 -0.408 . . . . 64.22 112.059 -176.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.92 -39.27 81.47 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.217 0.451 . . . . 74.53 112.217 -177.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 76.0 mtm -69.38 -33.79 73.57 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.789 0.328 . . . . 74.42 111.351 178.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.7 t -71.57 -21.69 61.84 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 111.882 0.327 . . . . 73.21 111.882 178.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -98.82 -60.49 1.53 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 112.48 0.548 . . . . 74.11 112.48 -177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.7 m-85 -101.61 141.99 33.63 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.446 0.536 . . . . 74.02 112.446 -173.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 68.9 p -97.99 -7.99 28.86 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 115.897 -0.592 . . . . 54.5 111.192 175.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.69 113.06 3.13 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.178 0.513 . . . . 74.41 111.462 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -55.16 -43.83 74.62 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.732 -0.667 . . . . 72.21 112.299 -173.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -64.61 -46.15 83.84 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.933 0.345 . . . . 75.41 111.933 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 75.3 mt -58.83 -38.76 79.37 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.041 0.448 . . . . 75.3 111.075 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.57 -51.0 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.548 176.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -61.13 -33.61 73.66 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.001 0.371 . . . . 73.24 112.001 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 55.3 m -52.45 -52.68 52.87 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.065 0.46 . . . . 74.11 111.065 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.469 ' O ' HG12 ' A' ' 66' ' ' ILE . 89.7 m -72.88 -48.43 37.44 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.066 -0.516 . . . . 64.14 111.188 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -49.58 -47.55 49.31 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.958 -0.564 . . . . 75.52 111.929 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 58.9 ttt-85 -70.14 -39.58 75.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.189 -0.46 . . . . 64.14 111.454 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.57 -42.76 99.75 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.296 0.48 . . . . 65.51 112.296 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 62' ' ' THR . 51.6 mm -53.78 -34.19 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 120.884 0.373 . . . . 65.15 111.813 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.7 t -52.66 -43.2 65.35 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 121.175 0.512 . . . . 60.35 111.638 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.2 mt -67.26 -37.55 83.66 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.145 -0.479 . . . . 75.3 111.537 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.532 ' OH ' ' HA ' ' A' ' 8' ' ' PHE . 77.6 m-85 -60.79 -23.85 65.34 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.109 0.411 . . . . 72.23 112.109 179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 25.1 mmt -87.79 -61.81 1.63 Allowed 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.084 0.469 . . . . 55.34 110.848 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.52 -48.74 80.47 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.812 0.671 . . . . 23.42 112.812 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.2 t-20 -64.6 -37.63 88.24 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.029 0.442 . . . . 73.01 111.092 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -63.4 -57.72 9.4 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.476 -0.329 . . . . 64.04 110.535 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -57.41 -37.27 72.47 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.002 0.371 . . . . 73.35 112.002 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -69.54 -29.59 67.22 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 111.913 0.338 . . . . 71.34 111.913 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -61.38 -35.04 76.38 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.215 0.531 . . . . 75.21 110.712 171.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -82.34 -35.52 27.77 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.082 -0.508 . . . . 71.55 111.125 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -123.31 99.87 6.55 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.857 0.36 . . . . 74.55 111.701 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -86.26 126.92 34.65 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.498 -0.319 . . . . 74.33 110.415 172.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.2 m80 . . . . . 0 C--O 1.252 1.217 0 CA-C-O 118.491 -0.766 . . . . 71.45 111.953 -178.14 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.483 ' HG2' ' H ' ' A' ' 3' ' ' GLY . 26.9 ttt . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 120.422 0.153 . . . . 74.32 110.763 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.89 -15.12 35.17 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.104 0.478 . . . . 42.3 111.764 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.483 ' H ' ' HG2' ' A' ' 1' ' ' MET . . . -101.67 -163.35 27.07 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.378 -0.439 . . . . 61.43 112.981 176.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -129.91 116.55 18.04 Favored Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 112.365 0.506 . . . . 63.34 112.365 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -101.68 9.37 0.49 Allowed 'Trans proline' 0 CA--C 1.547 1.132 0 C-N-CA 123.354 2.703 . . . . 61.44 112.702 168.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.75 -36.11 11.84 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 113.64 0.978 . . . . 75.44 113.64 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.7 p -50.95 -35.51 33.85 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 112.324 0.49 . . . . 70.35 112.324 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -55.42 -57.18 12.95 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.978 0.418 . . . . 62.13 111.226 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.412 ' HA ' HG22 ' A' ' 12' ' ' ILE . 92.9 t80 -65.51 -41.72 92.86 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.872 0.368 . . . . 72.0 111.18 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -64.07 -22.25 66.86 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 120.996 0.427 . . . . 63.23 111.252 -178.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -83.93 -56.56 3.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 120.942 0.401 . . . . 72.25 111.166 175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.412 HG22 ' HA ' ' A' ' 9' ' ' TYR . 10.2 tp -68.32 -22.06 27.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 N-CA-C 112.576 0.584 . . . . 70.51 112.576 -175.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.428 ' C ' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -59.22 -23.52 62.38 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.93 -0.481 . . . . 73.25 111.706 -179.634 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -61.37 -21.91 60.51 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 121.269 -0.491 . . . . 73.2 112.771 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -96.82 -11.05 25.38 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.92 0.391 . . . . 64.42 110.99 175.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -79.85 -27.15 40.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.763 0.425 . . . . 71.42 111.519 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -39.65 -52.39 2.24 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.502 0.556 . . . . 72.5 112.502 -177.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.17 175.3 7.11 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.199 0.523 . . . . 53.13 112.152 178.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -66.31 94.74 0.27 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.974 0.731 . . . . 61.41 112.974 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.7 p -128.07 157.59 73.56 Favored Pre-proline 0 N--CA 1.473 0.7 0 CA-C-N 115.981 -0.554 . . . . 75.35 110.218 173.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.32 -26.67 82.69 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.218 1.945 . . . . 34.4 111.679 173.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.55 ' HD1' HG23 ' A' ' 61' ' ' THR . 52.1 m-85 -75.71 -37.21 59.64 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.845 -0.616 . . . . 53.24 110.985 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.45 -30.07 64.45 Favored Glycine 0 CA--C 1.525 0.709 0 CA-C-N 115.978 -0.556 . . . . 21.33 113.086 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 50.0 mm -60.56 -39.74 82.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.853 0.359 . . . . 70.42 111.28 176.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -63.81 -52.52 59.83 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.831 0.348 . . . . 54.34 110.325 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.47 -41.87 77.3 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.042 0.448 . . . . 64.01 111.65 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.58 -44.32 91.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.143 0.497 . . . . 71.21 111.178 177.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 13.7 t60 -67.78 -32.45 73.03 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.917 -0.583 . . . . 62.43 111.91 -175.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.3 m -81.36 -25.69 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.887 0.375 . . . . 55.01 111.131 176.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 35.9 t -69.42 -16.86 63.58 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.366 -0.379 . . . . 75.32 111.65 178.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -70.35 -4.46 22.35 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 112.325 0.491 . . . . 71.42 112.325 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -91.74 138.19 31.76 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.387 0.613 . . . . 70.42 111.731 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -129.48 -36.23 1.68 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.618 0.599 . . . . 70.43 112.618 -178.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -147.3 15.93 1.16 Allowed 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.878 1.066 . . . . 72.21 113.878 -173.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -86.25 131.0 47.62 Favored Pre-proline 0 N--CA 1.47 0.554 0 O-C-N 121.84 -0.538 . . . . 75.05 110.557 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -71.46 81.52 1.24 Allowed 'Trans proline' 0 CA--C 1.54 0.817 0 C-N-CA 122.408 2.072 . . . . 74.03 113.042 -178.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -85.86 -23.69 26.99 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.348 -0.387 . . . . 61.32 111.415 176.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 8.1 mp 61.93 -82.47 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.978 0.511 . . . . 72.31 111.427 -177.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.758 ' HB3' HG12 ' A' ' 45' ' ' ILE . 52.8 mt-10 45.38 30.26 0.68 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.868 0.692 . . . . 75.35 112.868 177.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -54.05 -36.92 63.6 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.209 0.448 . . . . 72.52 112.209 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.565 ' O ' HG22 ' A' ' 44' ' ' VAL . 29.6 mmt180 -81.05 112.45 18.44 Favored 'General case' 0 N--CA 1.466 0.368 0 O-C-N 122.165 -0.334 . . . . 72.34 110.497 173.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.551 ' HB3' ' HE2' ' A' ' 69' ' ' TYR . 37.9 m80 -59.0 -9.83 2.15 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 113.198 0.814 . . . . 73.51 113.198 -175.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -91.7 -40.72 11.11 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 120.662 0.267 . . . . 73.33 111.5 177.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 41' ' ' ARG . 19.9 m -64.71 -20.11 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 112.201 0.445 . . . . 51.42 112.201 -176.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.758 HG12 ' HB3' ' A' ' 39' ' ' GLU . 52.6 mt -50.1 -43.71 21.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-O 121.433 0.635 . . . . 71.14 110.599 175.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 50' ' ' MET . 77.6 ttt180 -55.14 -44.65 75.28 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.255 -0.884 . . . . 72.12 111.454 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.26 -45.28 63.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.053 0.454 . . . . 72.51 111.736 179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -57.88 -48.79 78.8 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.268 -0.423 . . . . 62.42 111.405 -178.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 HG21 ' A' ' 62' ' ' THR . 33.1 m -65.57 -42.73 93.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 112.345 0.498 . . . . 64.02 112.345 -179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.654 ' HG2' HG23 ' A' ' 59' ' ' ILE . 70.5 mtm -62.84 -29.79 71.01 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 120.825 0.345 . . . . 74.43 111.735 179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 38.0 t -71.91 -7.78 50.54 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 112.321 0.489 . . . . 73.34 112.321 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -124.4 -49.59 1.79 Allowed 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 112.501 0.556 . . . . 65.04 112.501 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 13.6 m-30 -66.76 137.26 56.51 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.279 0.561 . . . . 73.52 112.164 -174.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 t -99.8 -36.71 9.35 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.364 0.876 . . . . 75.32 113.364 -173.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -79.04 152.84 30.67 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.557 0.577 . . . . 73.43 112.557 -174.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -59.72 -48.6 81.02 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.874 -0.603 . . . . 75.14 112.121 -178.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -64.62 -34.87 79.3 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 112.581 0.586 . . . . 73.22 112.581 -175.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 94.7 mt -60.91 -42.56 98.32 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.3 0.571 . . . . 71.1 111.03 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 50' ' ' MET . 66.1 mt -78.86 -38.48 21.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 115.882 -0.599 . . . . 54.04 111.156 176.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.61 -55.32 34.74 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.824 -0.626 . . . . 73.53 111.26 -177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.55 HG23 ' HD1' ' A' ' 22' ' ' PHE . 96.3 m -52.28 -44.62 65.07 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.699 -0.682 . . . . 54.34 111.315 178.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.65 HG21 HG21 ' A' ' 49' ' ' VAL . 91.4 m -62.27 -48.49 79.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.285 -0.416 . . . . 75.43 111.688 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.412 ' ND2' HG22 ' A' ' 59' ' ' ILE . 94.3 m-20 -58.75 -37.99 77.44 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 112.025 0.38 . . . . 65.14 112.025 -179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 54.9 ttt180 -73.63 -50.2 22.28 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.056 0.455 . . . . 72.54 110.976 176.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.38 -57.87 11.0 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.994 -0.548 . . . . 74.35 112.063 -177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.483 ' O ' ' HG3' ' A' ' 70' ' ' MET . 34.3 mm -50.81 -45.69 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 111.834 0.309 . . . . 74.44 111.834 -179.147 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.88 -59.36 5.55 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 120.807 0.337 . . . . 74.32 111.3 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.4 mp -72.52 -2.0 18.04 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.156 0.428 . . . . 73.42 112.156 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.551 ' HE2' ' HB3' ' A' ' 42' ' ' HIS . 21.9 t80 -92.03 -62.49 1.4 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.714 0.292 . . . . 73.31 110.964 172.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.544 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -65.58 -35.15 79.99 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.39 -0.194 . . . . 65.02 111.485 -178.098 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.455 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -80.25 -0.66 37.36 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.809 0.337 . . . . 72.22 111.701 178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -101.8 -47.12 4.71 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.736 0.303 . . . . 63.24 110.344 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.96 -64.05 0.98 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 116.084 -0.507 . . . . 71.35 111.342 -179.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 70' ' ' MET . 0.9 OUTLIER -64.12 -38.53 91.39 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 122.231 -0.293 . . . . 63.02 111.722 -177.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -62.17 -34.05 75.67 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.93 0.395 . . . . 73.54 110.993 176.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -75.1 -24.6 58.14 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.96 0.409 . . . . 74.44 110.66 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -89.74 -1.11 57.92 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.049 0.452 . . . . 74.13 110.972 175.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 36.2 m-70 -118.71 171.36 8.25 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 122.787 0.435 . . . . 75.44 110.759 172.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 44.8 m80 -145.83 173.61 11.97 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.975 0.417 . . . . 62.11 111.364 178.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.759 -0.639 . . . . 64.03 112.012 -179.232 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 120.772 0.32 . . . . 73.05 111.594 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.68 169.17 16.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.855 0.36 . . . . 74.21 111.692 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 77.9 89.85 0.35 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 121.1 -0.571 . . . . 74.2 112.723 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -60.72 122.97 72.26 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 112.462 0.541 . . . . 65.44 112.462 -176.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -95.31 -9.29 1.3 Allowed 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.121 2.548 . . . . 73.13 113.174 174.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.9 mtp -69.62 -52.73 23.26 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 111.901 0.334 . . . . 40.31 111.901 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.9 p 59.15 -67.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.113 0.965 . . . . 73.53 113.546 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.429 ' HZ ' HD11 ' A' ' 25' ' ' LEU . 90.6 t80 -33.21 -61.99 0.28 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.168 0.987 . . . . 75.11 113.343 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.547 ' O ' ' HG3' ' A' ' 13' ' ' MET . 90.8 t80 -59.14 -46.92 87.11 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.845 0.355 . . . . 70.14 111.632 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -60.4 -27.38 67.4 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-O 121.057 0.456 . . . . 64.34 111.662 -177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -81.52 -52.3 7.37 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.951 0.405 . . . . 61.33 111.636 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.662 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.3 tp -62.84 -22.81 31.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 N-CA-C 112.664 0.616 . . . . 74.41 112.664 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 61.2 mtm -55.61 -33.18 63.74 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 122.065 -0.397 . . . . 73.04 111.747 178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.95 -27.49 56.85 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.944 -0.646 . . . . 72.14 113.356 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.51 -19.81 28.97 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.571 -0.37 . . . . 72.22 111.633 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -70.46 -19.66 62.94 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.983 0.42 . . . . 70.24 111.331 178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -58.56 -31.38 67.93 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.307 -0.406 . . . . 75.13 110.932 177.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -117.74 153.84 32.72 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.101 -0.5 . . . . 43.23 110.918 178.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -80.27 84.28 5.97 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.315 0.579 . . . . 71.2 111.368 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 70.9 p -129.96 157.19 77.66 Favored Pre-proline 0 N--CA 1.474 0.736 0 CA-C-N 116.135 -0.484 . . . . 74.13 111.407 -178.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -51.87 -32.57 47.53 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 122.561 2.174 . . . . 72.41 112.735 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -69.37 -42.46 75.16 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.268 0.556 . . . . 71.52 110.294 173.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.14 -30.43 77.48 Favored Glycine 0 CA--C 1.526 0.755 0 CA-C-N 115.975 -0.557 . . . . 53.11 112.515 175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.7 mm -59.66 -37.72 72.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 120.94 0.4 . . . . 70.05 111.044 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD12 HG12 ' A' ' 12' ' ' ILE . 2.9 tm? -58.62 -50.73 72.76 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.62 -0.511 . . . . 74.42 109.62 174.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.662 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.43 -37.48 78.21 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.128 -0.487 . . . . 61.32 111.526 176.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -61.43 -53.29 58.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.121 0.486 . . . . 72.03 111.179 178.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 11.2 t60 -69.08 -33.92 74.3 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.302 -0.408 . . . . 72.45 112.061 -175.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.8 m -72.24 -28.7 29.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 121.823 -0.548 . . . . 70.41 110.95 175.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -73.83 -23.45 59.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.115 0.483 . . . . 65.41 110.623 172.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.94 -30.63 70.82 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.358 0.599 . . . . 74.4 111.0 175.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -76.06 168.66 19.63 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.006 -0.543 . . . . 72.22 110.204 172.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -61.05 -24.73 66.42 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.12 0.415 . . . . 74.13 112.12 -179.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 53.06 22.68 2.61 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.409 0.892 . . . . 75.12 113.409 172.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -106.54 140.17 21.06 Favored Pre-proline 0 CA--C 1.54 0.575 0 N-CA-C 109.804 -0.443 . . . . 61.34 109.804 178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -31.68 91.47 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.103 0 C-N-CA 123.724 2.949 . . . . 52.34 114.73 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.4 ttp180 -109.39 -59.43 1.9 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.068 -0.969 . . . . 64.45 110.064 176.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 23.2 tp -156.71 15.21 0.29 Allowed 'General case' 0 CA--C 1.544 0.75 0 CA-C-O 121.353 0.597 . . . . 70.2 110.498 172.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' HA ' HD11 ' A' ' 45' ' ' ILE . 19.6 mp0 -75.52 3.75 8.8 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.98 -0.555 . . . . 70.41 112.405 -175.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -66.44 -29.6 69.77 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.316 0.579 . . . . 44.32 110.849 175.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 44' ' ' VAL . 30.3 mmm180 -83.5 119.97 25.34 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.748 -0.66 . . . . 74.42 111.922 -175.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -82.18 25.94 0.56 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 120.948 0.404 . . . . 61.23 111.619 -178.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -130.9 -62.35 0.9 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.769 0.319 . . . . 75.31 111.197 -176.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.56 HG22 ' HB2' ' A' ' 41' ' ' ARG . 34.6 m -53.41 -29.06 16.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 N-CA-C 112.968 0.729 . . . . 72.4 112.968 -177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 39' ' ' GLU . 48.5 mm -53.91 -35.76 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.167 0.508 . . . . 73.44 110.869 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 32.6 ttm-85 -59.72 -39.77 85.78 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.75 -0.659 . . . . 63.02 110.682 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.28 -42.56 62.32 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.176 -0.465 . . . . 63.34 111.801 178.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -50.43 -55.77 14.37 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.154 0.427 . . . . 62.42 112.154 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 26.9 m -59.12 -39.42 78.49 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 112.234 0.457 . . . . 52.22 112.234 -177.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.1 mtm -76.1 -33.12 59.48 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 111.947 0.351 . . . . 33.42 111.947 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -76.78 -8.43 57.3 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.175 0.435 . . . . 74.13 112.175 -177.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -127.52 -26.75 2.97 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.016 0.747 . . . . 45.43 113.016 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -131.46 144.29 51.06 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.174 0.512 . . . . 62.54 112.045 -175.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.0 p -117.22 22.38 12.54 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.938 -0.574 . . . . 65.32 111.93 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.47 ' O ' HG12 ' A' ' 59' ' ' ILE . 20.7 t70 -100.23 118.71 37.1 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.096 0.474 . . . . 75.13 110.941 178.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -72.37 -20.33 61.47 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.196 0.813 . . . . 73.53 113.196 -173.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -69.44 -12.94 62.07 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.162 0.506 . . . . 73.01 110.423 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.7 mt -102.24 -42.23 6.1 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.907 -0.588 . . . . 61.05 110.932 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 55' ' ' ASP . 50.3 mm -59.9 -66.25 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.319 0.489 . . . . 73.22 112.319 -176.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -55.7 -37.63 68.63 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.104 0.409 . . . . 74.54 112.104 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 92.4 m -57.99 -42.85 86.01 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.943 0.402 . . . . 75.55 111.07 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 88.5 m -60.52 -45.11 95.03 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.148 -0.478 . . . . 44.04 111.023 176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.63 -44.48 81.3 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 116.247 -0.433 . . . . 75.25 111.381 177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 ttt85 -59.92 -53.63 55.67 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 120.668 0.27 . . . . 74.22 111.466 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.01 -43.53 70.14 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.048 0.388 . . . . 72.14 112.048 -177.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.6 mt -72.26 -38.65 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-O 120.983 0.421 . . . . 74.44 111.598 177.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -53.15 -45.71 68.53 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.67 0.619 . . . . 63.14 112.67 -175.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -58.56 -36.27 73.67 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.192 0.441 . . . . 63.21 112.192 -178.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -87.75 7.21 31.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.914 0.388 . . . . 70.34 111.956 -178.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 95.6 mmm -116.01 -66.85 1.04 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.305 -0.407 . . . . 73.45 110.726 174.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.46 -53.17 61.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.291 0.478 . . . . 64.12 112.291 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.494 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 35.1 t30 -64.49 -46.23 83.89 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.835 0.35 . . . . 70.41 111.087 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -42.12 64.45 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 116.125 -0.489 . . . . 60.13 111.117 -178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -58.11 -61.75 2.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.931 0.396 . . . . 71.11 111.852 177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -75.99 -9.39 58.57 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.569 0.581 . . . . 71.3 112.569 -175.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -65.52 -26.71 68.02 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 122.244 -0.285 . . . . 72.24 111.405 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -75.64 -67.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 120.973 0.416 . . . . 72.11 110.429 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -77.15 92.1 3.77 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 121.111 0.482 . . . . 64.34 111.257 175.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -68.83 148.17 50.66 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.153 -0.476 . . . . 75.35 111.047 174.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.0 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.273 -0.87 . . . . 73.43 111.778 -177.889 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.493 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.731 0.3 . . . . 75.03 111.488 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.7 -20.7 66.47 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.169 0.803 . . . . 42.23 113.169 -174.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.16 -79.73 1.02 Allowed Glycine 0 CA--C 1.527 0.834 0 C-N-CA 121.07 -0.586 . . . . 24.1 113.305 -178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.05 90.07 2.52 Favored Pre-proline 0 CA--C 1.544 0.735 0 CA-C-O 121.401 0.62 . . . . 64.43 111.723 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.612 ' HA ' ' HA ' ' A' ' 40' ' ' GLU . 89.4 Cg_endo -89.26 -56.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.591 2.194 . . . . 41.41 114.67 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 81.0 mtp -88.83 30.3 0.94 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.109 0.781 . . . . 62.25 113.109 -168.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 55.6 p -58.58 -49.3 77.97 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.935 0.397 . . . . 73.21 111.372 178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.515 ' HE2' HG11 ' A' ' 29' ' ' VAL . 90.4 t80 -47.99 -39.34 19.24 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.901 -0.59 . . . . 73.44 112.378 176.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -62.59 -38.0 88.42 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.781 0.324 . . . . 74.32 111.412 -178.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -80.39 -26.07 38.74 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 120.922 0.392 . . . . 71.15 111.007 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -64.07 -46.57 83.73 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.015 0.436 . . . . 74.51 111.454 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.522 HD11 ' HB3' ' A' ' 22' ' ' PHE . 10.1 tp -84.21 -9.62 11.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 CA-C-O 121.223 0.535 . . . . 74.4 111.563 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.475 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 9.2 tmm? -64.77 137.61 57.89 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.027 0.442 . . . . 75.14 110.593 179.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 106.91 -46.6 1.15 Allowed Glycine 0 CA--C 1.524 0.637 0 C-N-CA 120.92 -0.657 . . . . 43.42 112.203 -175.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -61.6 -33.22 73.52 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.211 0.529 . . . . 63.41 110.515 174.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.52 -23.25 67.31 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 115.792 -0.64 . . . . 62.44 111.852 176.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -80.65 -7.33 59.26 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 120.81 0.338 . . . . 74.52 111.83 -178.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -127.59 140.22 52.25 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.838 -0.43 . . . . 74.01 109.838 177.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -63.36 85.9 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.3 0.571 . . . . 72.31 111.234 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 78.3 p -125.01 155.45 70.71 Favored Pre-proline 0 N--CA 1.472 0.652 0 CA-C-N 115.952 -0.567 . . . . 73.52 111.346 -177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.79 -29.86 73.78 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 122.339 2.026 . . . . 74.23 112.426 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.522 ' HB3' HD11 ' A' ' 12' ' ' ILE . 76.7 m-85 -65.73 -28.25 68.91 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 116.207 -0.451 . . . . 73.14 111.059 178.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.14 -24.81 55.84 Favored Glycine 0 CA--C 1.527 0.811 0 CA-C-N 116.026 -0.534 . . . . 62.43 113.487 179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mm -67.43 -33.79 64.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 121.229 0.537 . . . . 65.35 111.061 178.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -83.98 -46.33 12.18 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.109 178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.413 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -57.93 -45.27 86.84 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.007 0.432 . . . . 75.43 111.889 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -64.99 -15.01 61.8 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.019 0.438 . . . . 64.54 111.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 86.0 t60 -90.7 -39.98 12.13 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 122.219 -0.3 . . . . 73.43 111.797 176.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.515 HG11 ' HE2' ' A' ' 8' ' ' PHE . 31.1 m -68.97 -22.09 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 O-C-N 121.936 -0.477 . . . . 74.34 111.204 178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.2 t -97.26 9.91 40.95 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-O 121.158 0.504 . . . . 74.32 110.734 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.451 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.0 tt0 -94.98 -62.75 1.26 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.051 -0.522 . . . . 75.45 111.942 -177.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -107.63 97.16 6.93 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.217 0.532 . . . . 75.45 112.08 -175.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -111.93 1.42 16.46 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.848 -0.615 . . . . 60.44 110.249 172.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.09 -32.66 70.01 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.986 -0.552 . . . . 65.11 111.635 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.434 ' HE2' HH11 ' A' ' 37' ' ' ARG . 80.5 t80 -90.71 117.5 67.99 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 116.51 -0.314 . . . . 73.3 110.724 176.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -60.9 106.24 0.36 Allowed 'Trans proline' 0 CA--C 1.54 0.806 0 C-N-CA 122.556 2.171 . . . . 74.24 113.183 -178.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.434 HH11 ' HE2' ' A' ' 35' ' ' PHE . 19.6 mmm180 -88.67 -86.76 0.17 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.484 -0.325 . . . . 54.1 110.794 174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.44 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 3.0 mm? 51.75 28.27 4.78 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.665 0.617 . . . . 72.4 112.665 174.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 40' ' ' GLU . 0.9 OUTLIER -58.9 -30.9 68.14 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 111.939 0.348 . . . . 61.53 111.939 179.836 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.612 ' HA ' ' HA ' ' A' ' 5' ' ' PRO . 43.0 tt0 76.39 -50.03 0.58 Allowed 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.222 0.609 . . . . 64.41 112.605 174.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -70.25 143.26 52.19 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 121.1 0.476 . . . . 64.51 111.744 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.594 ' HB3' HG23 ' A' ' 66' ' ' ILE . 36.3 m80 -78.85 -47.46 16.54 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.695 0.628 . . . . 74.02 112.695 -173.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -56.01 -36.81 68.37 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.457 0.91 . . . . 74.22 113.457 -170.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.0 m -67.64 -21.77 27.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 N-CA-C 113.71 1.004 . . . . 73.22 113.71 -173.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.495 ' HB ' HD11 ' A' ' 66' ' ' ILE . 59.5 mt -67.53 -26.63 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 N-CA-C 112.799 0.666 . . . . 74.33 112.799 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -56.48 -38.36 71.62 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.878 0.696 . . . . 73.44 112.878 -175.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.19 52.26 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.449 0.907 . . . . 42.2 113.449 -172.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -84.29 -46.13 12.11 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.455 0.539 . . . . 73.32 112.455 -177.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.48 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . 20.7 m -70.83 -43.63 76.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 O-C-N 122.096 -0.377 . . . . 72.12 111.295 177.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 64.6 mtt -78.8 65.12 3.95 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.42 0.629 . . . . 74.52 110.509 175.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.6 t -179.24 -59.75 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.317 -0.856 . . . . 72.1 110.549 -176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -87.45 -45.09 10.82 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.385 -0.371 . . . . 72.33 111.948 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 41.6 m-85 -98.81 125.32 44.15 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.008 0.432 . . . . 74.22 111.314 -175.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.1 p -86.35 -49.49 7.61 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 112.936 0.717 . . . . 62.12 112.936 -172.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -61.59 142.03 57.39 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.788 0.804 . . . . 73.54 112.798 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -59.6 -32.73 70.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.97 -1.014 . . . . 61.21 113.251 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -62.1 -49.6 75.26 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.81 0.338 . . . . 75.25 111.779 -176.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 84.3 mt -63.57 -38.29 90.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.322 0.582 . . . . 65.11 111.305 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.435 HG22 ' OD1' ' A' ' 63' ' ' ASN . 60.8 mt -67.95 -51.93 44.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 CA-C-N 115.772 -0.649 . . . . 74.44 111.439 178.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.494 ' HA ' HD21 ' A' ' 63' ' ' ASN . 5.2 mm-40 -57.4 -49.73 75.26 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.182 0.438 . . . . 75.23 112.182 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 85.7 m -50.46 -29.83 11.26 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.105 0.478 . . . . 72.54 111.475 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 41.2 m -88.1 -62.99 1.37 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.246 0.462 . . . . 73.41 112.246 -178.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.672 HD22 ' N ' ' A' ' 64' ' ' ARG . 0.3 OUTLIER -67.57 -21.47 65.43 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.729 0.64 . . . . 71.32 112.729 -173.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.672 ' N ' HD22 ' A' ' 63' ' ' ASN . 27.9 ttm180 -67.87 -49.1 63.96 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.74 0.305 . . . . 74.11 110.724 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.06 -45.23 68.02 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.001 0.429 . . . . 41.03 110.722 176.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 42' ' ' HIS . 73.6 mt -53.13 -47.48 55.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-N 115.977 -0.556 . . . . 73.43 111.145 174.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 47.4 t -61.23 -45.96 92.38 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.977 -0.556 . . . . 73.11 111.634 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.9 mp -60.88 -43.98 97.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.308 -0.405 . . . . 71.33 111.5 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -57.22 -34.18 68.3 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 120.764 0.316 . . . . 63.13 111.536 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.453 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 24.9 mmt -67.2 -66.3 0.58 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.094 0.473 . . . . 74.21 110.962 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -55.62 -41.08 73.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.172 -0.467 . . . . 43.2 112.249 -176.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -61.04 -56.87 15.95 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.148 -0.478 . . . . 72.42 110.914 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.42 -48.65 80.82 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.764 0.316 . . . . 53.33 111.362 -177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 70' ' ' MET . 29.7 mm-40 -53.42 -49.08 68.08 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.527 0.565 . . . . 70.24 112.527 -177.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -82.29 -35.93 27.51 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.025 0.38 . . . . 74.1 112.025 -176.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -58.81 -39.76 82.12 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.127 0.417 . . . . 74.34 112.127 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -87.15 -3.87 59.09 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 122.102 -0.374 . . . . 65.32 111.249 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 18.2 m170 59.33 -173.59 0.1 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 122.945 0.498 . . . . 73.13 111.801 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -131.14 1.11 4.21 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.118 0.485 . . . . 72.3 110.408 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 60.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-N 116.05 -0.523 . . . . 44.31 110.649 178.374 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.6 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 120.915 0.388 . . . . 75.4 111.545 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.14 107.76 9.55 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.89 0.376 . . . . 73.33 111.019 175.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.07 -74.65 1.99 Allowed Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.103 -0.57 . . . . 75.32 112.799 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -169.46 106.35 0.47 Allowed Pre-proline 0 CA--C 1.54 0.57 0 CA-C-O 120.719 0.295 . . . . 74.54 111.263 176.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.91 -20.11 34.53 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 122.558 2.172 . . . . 73.22 112.546 175.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.414 ' O ' ' N ' ' A' ' 8' ' ' PHE . 25.5 mmt -66.28 -69.33 0.31 Allowed 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.074 0.398 . . . . 74.42 112.074 -176.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.6 p 44.94 -84.62 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.165 0.586 . . . . 74.24 112.564 -177.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 6' ' ' MET . 66.3 t80 -53.34 -51.28 62.93 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.875 0.369 . . . . 64.2 110.918 175.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -60.44 -33.41 72.49 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.386 0.612 . . . . 33.42 110.91 177.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -72.34 -31.96 66.08 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.491 -0.777 . . . . 72.14 111.961 179.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.9 t80 -90.89 -40.56 11.67 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.062 0.393 . . . . 73.05 112.062 -175.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.56 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -59.63 -35.63 60.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 112.088 0.403 . . . . 73.42 112.088 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 74.2 mtm -63.27 -21.92 66.55 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.875 0.369 . . . . 64.24 111.404 177.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -64.25 -23.02 67.8 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.146 -0.549 . . . . 71.23 112.753 175.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.443 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 97.3 m-85 -83.15 -29.39 28.67 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.925 0.393 . . . . 74.32 110.912 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -68.96 -9.82 54.16 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.411 0.624 . . . . 72.41 110.837 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -61.6 -17.64 55.97 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.961 -0.563 . . . . 71.25 110.653 173.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -139.22 155.86 47.5 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.356 -0.384 . . . . 75.4 110.465 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.49 87.61 0.12 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.284 0.564 . . . . 71.04 111.431 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.5 p -132.35 154.3 81.54 Favored Pre-proline 0 N--CA 1.469 0.487 0 CA-C-N 116.195 -0.457 . . . . 72.15 111.462 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.94 -27.15 71.61 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.284 1.989 . . . . 70.23 111.999 173.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.443 ' HB2' ' HB3' ' A' ' 15' ' ' PHE . 15.4 m-85 -61.63 -39.95 93.15 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.721 -0.672 . . . . 71.44 110.737 176.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.2 -33.57 86.38 Favored Glycine 0 CA--C 1.528 0.855 0 CA-C-N 115.851 -0.613 . . . . 65.01 113.26 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.4 mm -56.07 -48.42 78.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-O 121.175 0.512 . . . . 73.54 110.603 175.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.607 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.2 tm? -57.65 -47.87 81.04 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.846 -0.615 . . . . 74.34 110.347 175.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.56 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.02 -55.47 17.3 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.717 0.636 . . . . 73.51 112.717 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -78.72 -17.85 55.22 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.305 0.483 . . . . 51.35 112.305 -177.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 36.2 t60 -80.88 -31.9 35.09 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 122.186 -0.321 . . . . 72.43 111.784 177.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.2 m -81.38 -33.24 12.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 120.999 0.428 . . . . 71.43 110.62 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -68.45 -20.87 64.66 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.261 0.553 . . . . 73.14 110.753 172.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 28' ' ' HIS . 35.1 tt0 -53.68 -52.34 60.33 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.548 -0.751 . . . . 52.03 111.519 178.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -79.99 80.0 6.45 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.516 0.674 . . . . 51.04 111.424 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -107.85 8.95 28.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.57 -0.741 . . . . 54.13 109.806 169.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -77.15 -31.77 55.82 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.302 -0.863 . . . . 51.34 110.764 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -112.59 90.03 14.03 Favored Pre-proline 0 CA--C 1.539 0.558 0 CA-C-N 116.032 -0.531 . . . . 71.14 110.625 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.6 102.11 0.59 Allowed 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.534 2.156 . . . . 71.12 112.858 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 33.2 mmt180 -81.99 -64.73 1.12 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.822 0.344 . . . . 75.24 110.702 178.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 7.8 mp 54.48 36.38 25.53 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 120.984 0.421 . . . . 73.03 111.71 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -49.76 -28.79 6.66 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.715 -0.675 . . . . 71.0 112.728 -177.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 73.55 -52.59 0.7 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.425 0.69 . . . . 55.14 111.829 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.514 ' O ' HG22 ' A' ' 44' ' ' VAL . 69.9 mtt180 -57.15 109.51 0.67 Allowed 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 120.908 0.385 . . . . 75.44 110.544 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -75.46 -26.72 58.49 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.41 0.522 . . . . 73.32 112.41 -170.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -58.91 -33.71 70.86 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.75 0.648 . . . . 71.43 112.75 -177.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 41' ' ' ARG . 29.9 m -73.23 -25.73 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 N-CA-C 112.466 0.543 . . . . 75.13 112.466 -176.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 65.2 mt -58.52 -47.42 88.4 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 CA-C-O 121.096 0.474 . . . . 64.32 111.669 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -61.54 -27.08 68.36 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.264 -0.426 . . . . 72.33 111.92 -178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.08 -50.06 31.33 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.112 0.482 . . . . 73.51 111.149 178.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.0 m-85 -62.39 -36.64 82.94 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 112.759 0.651 . . . . 72.22 112.759 -178.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.539 HG11 HG21 ' A' ' 62' ' ' THR . 25.5 m -63.89 -31.5 53.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 122.094 -0.379 . . . . 62.11 111.614 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -68.77 -30.21 68.75 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.922 0.391 . . . . 73.45 111.269 176.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 30.7 t -75.75 -37.67 59.11 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.093 0.473 . . . . 62.14 111.768 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -87.62 -44.86 10.91 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.84 0.681 . . . . 53.45 112.84 -176.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -105.07 116.87 32.69 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 112.12 0.415 . . . . 72.31 112.12 -172.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.7 t -86.92 -17.07 34.07 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.309 0.576 . . . . 75.11 110.514 171.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -63.67 100.55 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.9 -0.591 . . . . 71.42 111.391 178.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.9 m80 -56.52 -24.38 46.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.881 -0.599 . . . . 72.51 112.077 -175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -59.61 -54.25 48.68 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.158 0.504 . . . . 61.15 110.486 174.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 25' ' ' LEU . 70.3 mt -66.99 -32.42 73.64 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.003 -0.544 . . . . 74.34 111.398 -178.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 64.6 mt -66.02 -54.82 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 CA-C-N 116.257 -0.428 . . . . 70.13 111.217 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.19 -33.39 69.22 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.146 0.498 . . . . 60.1 111.244 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.413 HG23 ' HD2' ' A' ' 22' ' ' PHE . 42.6 m -63.54 -48.09 78.95 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.102 0.477 . . . . 44.14 111.147 174.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.539 HG21 HG11 ' A' ' 49' ' ' VAL . 93.9 m -69.0 -52.93 23.62 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.303 0.483 . . . . 71.23 112.303 -177.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.417 ' OD1' ' N ' ' A' ' 64' ' ' ARG . 33.0 p30 -61.43 -38.58 87.69 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.163 0.431 . . . . 62.31 112.163 -173.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 64' ' ' ARG . 43.6 ttm180 -69.87 -43.64 71.44 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.79 0.329 . . . . 72.24 111.318 178.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.88 -45.22 86.7 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.984 0.421 . . . . 74.01 111.554 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 61.0 mt -69.99 -40.18 78.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.972 0.415 . . . . 73.22 111.179 176.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -55.94 -38.24 70.07 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 116.365 -0.38 . . . . 72.11 111.663 179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 64' ' ' ARG . 91.5 mt -56.73 -42.36 79.1 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.863 0.364 . . . . 35.53 111.463 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -71.06 -15.63 62.55 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.787 0.327 . . . . 72.4 111.808 176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 59.5 mtt -90.36 -25.03 20.64 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-O 121.039 0.447 . . . . 75.22 111.369 175.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -92.62 -61.59 1.57 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 112.048 0.388 . . . . 72.04 112.048 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 38.6 t-20 -51.83 -39.91 59.61 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 116.404 -0.362 . . . . 64.21 111.349 -178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.44 -51.19 70.44 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.441 -0.345 . . . . 71.24 110.524 179.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -61.45 -42.43 98.75 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.261 0.553 . . . . 72.14 111.149 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.3 t-160 -60.67 -30.85 70.17 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 121.249 0.547 . . . . 71.41 110.964 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -85.25 -28.12 25.57 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.795 -0.639 . . . . 75.52 111.129 176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -72.25 -26.88 62.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.014 0.435 . . . . 74.4 111.595 -178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -144.63 87.75 1.88 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.853 0.358 . . . . 72.41 110.617 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -93.4 -18.24 22.59 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.098 0.475 . . . . 75.13 110.982 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 25.9 m80 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 118.637 -0.697 . . . . 63.22 110.892 174.287 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.519 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.4 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.644 0.259 . . . . 73.14 111.179 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.52 29.04 18.17 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 122.726 0.41 . . . . 71.51 111.979 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -159.71 179.11 35.5 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 120.771 -0.728 . . . . 73.12 113.908 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -163.05 74.61 1.96 Allowed Pre-proline 0 CA--C 1.547 0.854 0 CA-C-O 121.341 0.591 . . . . 70.21 111.001 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.63 -59.82 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.012 2.475 . . . . 35.13 113.368 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.4 mtt 53.49 30.04 9.94 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.099 0.407 . . . . 63.32 112.099 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 77.4 p -53.63 -48.86 68.95 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.002 0.43 . . . . 74.24 111.847 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -53.14 -41.32 64.98 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 116.224 -0.444 . . . . 75.23 111.631 176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.586 ' O ' ' HG2' ' A' ' 13' ' ' MET . 56.9 t80 -60.17 -55.31 35.36 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.185 -0.461 . . . . 65.31 110.971 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -58.84 -36.8 75.16 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.041 0.448 . . . . 72.02 111.437 178.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -63.79 -49.75 71.66 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 116.332 -0.395 . . . . 74.42 111.65 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.691 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.6 tp -73.63 -17.52 17.48 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 N-CA-C 112.032 0.382 . . . . 74.32 112.032 -175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.586 ' HG2' ' O ' ' A' ' 9' ' ' TYR . 30.1 mmt -52.79 -36.64 58.53 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 112.396 0.517 . . . . 72.0 112.396 177.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -59.86 -40.05 96.27 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.179 -0.534 . . . . 61.54 112.878 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -77.05 -12.45 59.94 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 120.954 0.407 . . . . 71.03 111.175 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 25.6 tm0? -88.97 -25.54 21.99 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.221 -0.445 . . . . 72.22 110.573 178.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -54.73 -62.2 1.81 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.223 -0.444 . . . . 72.14 110.851 178.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -95.42 119.54 34.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 109.537 -0.542 . . . . 72.03 109.537 169.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -60.62 93.54 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 113.202 0.816 . . . . 71.44 113.202 -169.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 82.3 p -99.0 157.05 34.78 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 115.483 -0.78 . . . . 74.24 110.984 175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -56.34 -23.14 44.9 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 122.389 2.059 . . . . 62.2 112.188 176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -85.9 -38.02 18.49 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.914 -0.584 . . . . 73.22 110.469 176.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -61.3 -20.09 58.17 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.287 -0.415 . . . . 32.35 113.495 178.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.83 -35.83 47.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 CA-C-O 121.392 0.615 . . . . 63.42 110.782 174.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.535 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -58.68 -46.49 87.12 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.88 -0.6 . . . . 70.0 110.257 176.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.691 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.35 -42.83 87.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.087 -0.506 . . . . 64.25 111.598 177.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -59.97 -45.67 91.93 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.178 0.513 . . . . 61.52 111.201 178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -70.7 -43.92 68.01 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.123 0.416 . . . . 64.53 112.123 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 m -63.57 -23.1 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 O-C-N 121.684 -0.635 . . . . 73.15 111.504 -179.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.3 t -67.61 -37.95 83.24 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.002 0.429 . . . . 61.22 110.5 172.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -61.54 -53.21 59.4 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.185 0.517 . . . . 70.23 110.556 174.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -67.45 -2.82 6.96 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.634 0.605 . . . . 72.4 112.634 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -60.93 -31.42 70.95 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.076 0.465 . . . . 71.42 110.304 177.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.87 18.7 1.53 Allowed 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 116.284 -0.416 . . . . 51.01 111.912 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -122.45 140.11 32.14 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.687 0.395 . . . . 63.4 110.295 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.21 101.6 0.06 OUTLIER 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.863 2.375 . . . . 75.11 112.893 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -129.24 -50.75 1.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.981 -0.554 . . . . 62.05 110.965 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 38' ' ' LEU . 6.9 mp 49.99 66.63 1.08 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.015 -0.539 . . . . 73.02 111.549 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -90.58 87.13 6.61 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.453 0.645 . . . . 72.4 111.784 -175.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -98.54 -55.43 2.75 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.808 0.813 . . . . 74.1 110.138 174.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.594 ' O ' HG22 ' A' ' 44' ' ' VAL . 30.3 mtp85 -64.08 120.74 12.63 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 114.737 -1.12 . . . . 74.1 110.713 -179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.405 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 24.6 m170 -57.01 -23.32 45.36 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 112.507 0.558 . . . . 74.22 112.507 -171.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.38 -33.59 37.05 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 112.498 0.555 . . . . 73.42 112.498 -176.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 41' ' ' ARG . 18.7 m -59.63 -37.75 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 N-CA-C 112.445 0.535 . . . . 61.2 112.445 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.7 mt -56.04 -37.87 50.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.298 0.571 . . . . 74.21 111.298 -179.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NE ' ' SD ' ' A' ' 50' ' ' MET . 33.3 ttt180 -63.75 -33.66 76.15 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.078 -0.51 . . . . 74.22 111.315 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.42 -46.29 80.54 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.808 0.337 . . . . 71.02 111.243 178.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -54.39 -52.8 60.56 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.893 0.377 . . . . 65.32 111.748 177.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.482 HG23 ' N ' ' A' ' 50' ' ' MET . 26.9 m -69.74 -56.02 12.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.921 0.712 . . . . 72.42 112.921 -176.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.482 ' N ' HG23 ' A' ' 49' ' ' VAL . 74.4 mtp -64.76 -21.83 66.85 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 112.779 0.659 . . . . 63.41 112.779 -171.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.5 t -84.28 -38.85 19.93 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.193 0.442 . . . . 72.12 112.193 179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -111.3 -4.35 14.98 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.132 0.79 . . . . 63.45 113.132 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.406 ' CD1' ' HA ' ' A' ' 49' ' ' VAL . 15.2 m-85 -118.06 139.69 50.85 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.177 0.513 . . . . 71.13 111.94 -177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 73.3 p -107.24 -31.75 8.09 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.892 -0.595 . . . . 73.14 111.701 178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -57.31 113.17 1.63 Allowed 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.92 0.711 . . . . 61.15 112.92 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -55.43 -37.01 67.14 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.278 -0.419 . . . . 73.33 111.399 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -54.6 -37.18 65.25 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.035 0.445 . . . . 73.52 111.564 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 25' ' ' LEU . 54.6 mt -86.95 -40.48 14.76 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.955 0.407 . . . . 54.35 111.356 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.67 -54.8 29.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-N 116.494 -0.321 . . . . 73.01 111.767 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -54.17 -47.5 71.93 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 122.534 0.334 . . . . 61.41 111.732 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 96.5 m -55.0 -51.64 65.63 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.319 -0.4 . . . . 72.51 111.729 -179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.6 m -65.74 -49.77 67.2 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.976 0.417 . . . . 74.04 111.236 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -53.44 -39.04 64.1 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.974 -0.557 . . . . 73.23 111.479 178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 -76.79 -53.34 8.06 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.901 -0.591 . . . . 64.54 111.387 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 68' ' ' LEU . . . -55.16 -42.59 73.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.711 0.634 . . . . 71.4 112.711 -176.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.4 mt -60.44 -37.9 76.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.942 0.401 . . . . 73.34 111.281 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 55.4 m -59.36 -27.6 66.1 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.459 -0.337 . . . . 64.02 111.323 178.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 4.2 mm? -66.48 -51.59 55.13 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.979 0.419 . . . . 53.44 110.994 174.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -82.63 15.44 2.59 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.054 0.454 . . . . 65.52 111.89 -179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.491 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 93.1 mmm -126.08 -79.0 0.6 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.981 -0.554 . . . . 65.04 110.416 170.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.78 -54.11 49.21 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.039 0.385 . . . . 74.01 112.039 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.455 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 44.6 t-20 -62.23 -41.4 98.37 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.716 0.293 . . . . 65.41 110.629 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 tp -58.13 -39.1 77.87 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 120.902 0.382 . . . . 51.34 110.853 175.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 70' ' ' MET . 44.8 mt-10 -63.31 -31.95 73.24 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.588 -0.278 . . . . 62.4 111.366 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 87.4 m-70 -69.46 -24.04 63.74 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.172 0.511 . . . . 62.04 110.852 173.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -81.78 6.02 16.82 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.004 -0.544 . . . . 75.42 111.394 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -148.82 -55.72 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.974 0.416 . . . . 74.44 110.976 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -98.0 -170.99 2.07 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.127 0.489 . . . . 75.04 111.198 175.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -109.36 27.63 9.34 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.929 0.395 . . . . 74.41 111.141 176.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 74' ' ' GLU . 34.1 t-80 . . . . . 0 C--O 1.254 1.325 0 CA-C-O 118.665 -0.683 . . . . 72.14 111.907 -178.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.585 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 CA-C-O 120.498 0.189 . . . . 72.13 111.164 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.39 -64.22 0.53 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.041 0.448 . . . . 53.43 111.517 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -87.37 76.96 1.98 Allowed Glycine 0 CA--C 1.524 0.594 0 C-N-CA 121.161 -0.542 . . . . 62.42 112.573 178.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -116.48 90.18 29.6 Favored Pre-proline 0 CA--C 1.546 0.806 0 CA-C-O 120.688 0.28 . . . . 71.31 111.081 -178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HB2' HG23 ' A' ' 7' ' ' THR . 56.4 Cg_endo -91.24 -5.44 4.1 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.825 2.35 . . . . 65.24 113.158 177.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 63.9 mtt 57.39 25.49 11.36 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.5 0.555 . . . . 54.15 112.5 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.48 HG23 ' HB2' ' A' ' 5' ' ' PRO . 29.8 p -65.86 -14.59 61.76 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 112.463 0.542 . . . . 70.21 112.463 -175.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.438 ' HB2' ' CD2' ' A' ' 42' ' ' HIS . 78.3 t80 -87.03 -59.39 2.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.288 0.566 . . . . 75.32 110.88 171.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.441 ' O ' ' HG3' ' A' ' 13' ' ' MET . 74.1 t80 -57.63 -46.17 84.49 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.81 -0.632 . . . . 74.24 112.167 -178.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -63.17 -43.55 97.95 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.056 0.455 . . . . 75.43 111.746 179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.37 -50.72 72.87 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.241 -0.436 . . . . 72.42 111.613 -178.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.562 HG12 HD12 ' A' ' 25' ' ' LEU . 10.6 tp -63.83 -34.82 70.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 N-CA-C 111.813 0.301 . . . . 74.14 111.813 -178.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.441 ' HG3' ' O ' ' A' ' 9' ' ' TYR . 49.8 mtm -65.52 -16.34 63.58 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 122.173 -0.33 . . . . 74.24 111.614 177.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -60.35 -19.52 53.06 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 120.963 -0.637 . . . . 50.5 112.619 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -106.81 -0.94 23.03 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 120.928 0.394 . . . . 73.41 111.194 177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -83.12 76.59 9.85 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.481 0.658 . . . . 61.35 111.311 -177.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -143.87 -57.34 0.39 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.953 -0.567 . . . . 73.41 110.446 178.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -96.84 177.5 5.61 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.918 -0.583 . . . . 74.31 111.135 177.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -73.83 95.86 2.48 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.166 0.508 . . . . 73.13 109.942 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.8 p -128.2 152.93 78.61 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 116.131 -0.486 . . . . 72.32 111.482 -176.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.422 ' HB3' HE22 ' A' ' 57' ' ' GLN . 60.7 Cg_exo -54.5 -28.09 53.07 Favored 'Trans proline' 0 CA--C 1.541 0.851 0 C-N-CA 122.412 2.075 . . . . 74.42 112.296 173.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -68.78 -35.02 76.52 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.879 -0.6 . . . . 73.35 111.199 178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.42 -29.18 65.88 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 121.292 -0.48 . . . . 53.33 113.079 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 49.8 mm -63.25 -38.58 82.5 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-O 121.165 0.507 . . . . 63.23 110.795 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.562 HD12 HG12 ' A' ' 12' ' ' ILE . 3.2 tm? -76.5 -48.43 19.5 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.104 -0.498 . . . . 71.53 110.463 178.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -53.22 -60.27 3.51 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.763 0.653 . . . . 50.42 112.763 -177.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -71.33 -8.52 54.25 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.394 0.516 . . . . 73.01 112.394 -177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -91.08 -44.2 9.44 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.71 0.291 . . . . 72.11 110.905 177.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.5 m -75.21 -21.68 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 120.727 0.299 . . . . 44.22 111.377 176.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 43.4 t -57.68 -29.84 64.98 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.053 0.454 . . . . 43.24 111.03 174.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -151.77 85.83 1.31 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.225 -0.443 . . . . 64.25 111.395 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.41 ' CG ' ' N ' ' A' ' 33' ' ' LYS . 9.0 p-10 -83.96 -53.47 5.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.537 0.684 . . . . 63.51 109.167 173.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 34' ' ' ALA . 55.6 mtmt -160.27 -55.74 0.06 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.187 1.395 . . . . 72.22 107.669 176.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LYS . . . 163.09 28.66 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 114.931 -1.031 . . . . 63.41 111.869 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -123.39 88.43 51.51 Favored Pre-proline 0 N--CA 1.473 0.71 0 N-CA-C 113.844 1.053 . . . . 73.41 113.844 -169.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_exo -72.85 99.25 1.06 Allowed 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.4 2.067 . . . . 70.32 110.313 166.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 37' ' ' ARG . 27.5 mmt180 -59.33 -62.38 1.92 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 113.862 1.06 . . . . 73.33 113.862 -170.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.479 ' HB3' HG21 ' A' ' 44' ' ' VAL . 28.3 tp -167.09 114.37 0.8 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 120.594 -0.443 . . . . 71.33 111.876 -173.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -91.69 4.62 52.33 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.718 0.294 . . . . 73.33 111.44 176.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.92 -63.01 1.35 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.173 0.511 . . . . 74.21 109.623 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 44.9 mtt180 -132.83 116.55 16.65 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.971 -0.558 . . . . 74.42 110.153 172.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.438 ' CD2' ' HB2' ' A' ' 8' ' ' PHE . 79.7 m80 -64.71 -3.84 3.66 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 112.683 0.623 . . . . 60.43 112.683 -174.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -57.82 -33.56 68.74 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.763 0.316 . . . . 51.12 111.157 174.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.479 HG21 ' HB3' ' A' ' 38' ' ' LEU . 34.9 m -59.43 -44.34 92.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.963 0.411 . . . . 64.32 111.038 176.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 49' ' ' VAL . 60.6 mt -61.63 -53.13 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-O 121.204 0.526 . . . . 74.44 110.062 175.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -46.29 -48.54 18.1 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 115.17 -0.923 . . . . 65.2 112.247 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.9 65.4 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 112.699 0.629 . . . . 74.01 112.699 -177.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -79.17 -27.74 42.7 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.347 0.869 . . . . 73.24 113.347 -173.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.483 HG11 HG21 ' A' ' 62' ' ' THR . 27.6 m -63.59 -32.13 55.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.733 -0.604 . . . . 61.01 111.487 177.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.9 mtm -74.93 -11.42 60.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.067 0.461 . . . . 63.43 111.497 177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -101.83 -52.5 3.17 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.188 -0.46 . . . . 62.51 111.643 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 58.6 m-20 -76.62 -47.62 21.72 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 112.458 0.54 . . . . 72.22 112.458 -175.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.475 ' HD2' ' HA ' ' A' ' 49' ' ' VAL . 96.6 m-85 -81.75 157.78 24.4 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.321 0.582 . . . . 55.14 112.413 -173.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.6 p -107.23 -61.68 1.52 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.85 -0.614 . . . . 75.44 112.251 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -56.17 127.91 33.01 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.256 0.465 . . . . 75.24 112.256 178.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.408 ' HA ' ' HB ' ' A' ' 59' ' ' ILE . 32.8 m80 -65.7 -24.42 66.99 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 122.103 -0.373 . . . . 73.31 110.824 174.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.422 HE22 ' HB3' ' A' ' 21' ' ' PRO . 14.9 mm100 -57.99 -20.44 38.43 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.336 0.589 . . . . 73.41 110.82 171.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 25' ' ' LEU . 78.9 mt -99.36 -55.83 2.57 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.786 -0.643 . . . . 73.24 110.356 171.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.408 ' HB ' ' HA ' ' A' ' 56' ' ' HIS . 62.5 mt -58.46 -65.38 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 N-CA-C 112.624 0.601 . . . . 62.52 112.624 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.701 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.6 tt0 -65.35 -40.25 93.39 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.583 -0.28 . . . . 75.31 111.672 -173.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 89.8 m -54.89 -41.85 71.4 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 120.605 0.24 . . . . 62.31 110.992 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.483 HG21 HG11 ' A' ' 49' ' ' VAL . 52.9 m -62.86 -63.24 1.27 Allowed 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 111.795 0.294 . . . . 72.23 111.795 178.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.701 HD21 ' HA ' ' A' ' 60' ' ' GLU . 11.1 p30 -63.83 -30.23 71.34 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 122.165 -0.335 . . . . 75.34 111.555 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -63.62 -50.32 69.83 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.081 0.467 . . . . 74.52 110.326 174.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.32 -41.84 90.04 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.053 -0.522 . . . . 74.2 111.096 177.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 62' ' ' THR . 47.2 mm -64.72 -36.33 77.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 CA-C-N 116.442 -0.344 . . . . 74.15 111.355 177.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.1 m -63.73 -50.3 69.66 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.694 0.283 . . . . 71.0 111.177 177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.49 -34.85 78.84 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.703 0.287 . . . . 63.14 111.123 176.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -60.61 -57.1 14.15 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.495 -0.32 . . . . 75.02 111.415 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 71' ' ' ALA . 4.5 ppp? -65.93 -34.47 78.2 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.697 -0.229 . . . . 62.11 111.43 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.404 ' N ' ' SD ' ' A' ' 70' ' ' MET . . . -67.58 -47.41 69.85 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-O 120.786 0.327 . . . . 74.32 111.756 178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -67.58 -45.78 74.55 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.821 0.343 . . . . 74.24 110.851 178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -57.3 -46.86 82.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.951 0.405 . . . . 63.15 110.019 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -54.89 -51.49 65.82 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.063 -0.517 . . . . 74.13 111.413 175.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -69.54 -26.46 64.52 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.463 -0.335 . . . . 64.21 111.846 -177.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -81.1 -35.74 31.28 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.015 0.436 . . . . 64.41 110.995 178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -76.55 -36.95 57.35 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.219 0.533 . . . . 72.4 110.783 176.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -80.53 -29.41 37.2 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.833 -0.621 . . . . 74.01 110.921 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 66.77 -74.47 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.46 0.704 . . . . 72.03 112.511 178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.78 -0.628 . . . . 74.45 111.665 -176.744 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 120.675 0.274 . . . . 75.35 111.272 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.84 107.45 2.55 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 112.055 0.391 . . . . 61.11 112.055 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 148.57 -48.58 0.61 Allowed Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.873 -0.68 . . . . 75.13 113.889 176.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.403 ' CB ' ' HA ' ' A' ' 38' ' ' LEU . 10.3 t70 -94.97 120.49 64.36 Favored Pre-proline 0 CA--C 1.543 0.683 0 N-CA-C 112.324 0.49 . . . . 72.24 112.324 -175.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.1 Cg_endo -89.67 11.15 2.93 Favored 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.965 2.443 . . . . 71.55 113.272 174.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.2 mtm 61.03 52.08 4.22 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.832 0.453 . . . . 75.32 111.935 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.3 p -60.32 -53.73 54.1 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.216 0.45 . . . . 65.3 112.216 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -57.37 -52.26 66.09 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.919 0.39 . . . . 73.43 111.506 178.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -57.31 -42.9 82.68 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.167 -0.469 . . . . 73.25 111.531 179.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.62 -37.23 72.94 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.389 -0.369 . . . . 63.23 111.661 -178.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -78.2 -57.21 3.91 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.028 0.442 . . . . 73.13 111.737 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.638 HG12 HD12 ' A' ' 25' ' ' LEU . 10.1 tp -62.72 -30.36 49.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 112.734 0.642 . . . . 71.02 112.734 -172.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.42 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -57.16 -29.51 63.69 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.065 0.395 . . . . 75.02 112.065 -177.231 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . -58.64 -31.36 67.13 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 121.02 -0.609 . . . . 54.24 113.214 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -73.54 -18.95 61.02 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 122.655 -0.321 . . . . 63.43 111.584 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HB2' ' CB ' ' A' ' 26' ' ' ALA . 0.4 OUTLIER -78.5 -30.43 47.17 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.185 0.517 . . . . 70.21 110.263 179.38 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -64.11 -14.03 51.97 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.682 0.623 . . . . 75.1 112.682 -178.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -134.01 151.59 51.5 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.775 0.322 . . . . 62.34 110.591 176.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -66.86 83.07 0.11 Allowed 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.359 0.6 . . . . 73.12 111.49 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 34.7 p -119.05 154.31 53.24 Favored Pre-proline 0 N--CA 1.47 0.561 0 CA-C-N 116.021 -0.536 . . . . 74.12 110.894 179.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.3 -31.14 81.87 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 122.35 2.033 . . . . 72.22 112.27 174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -74.4 -28.8 61.26 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 116.062 -0.517 . . . . 60.12 111.099 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.72 -22.14 31.95 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-N 116.045 -0.525 . . . . 71.35 113.69 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.1 mt -60.86 -42.17 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.125 0.488 . . . . 63.35 111.218 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.638 HD12 HG12 ' A' ' 12' ' ' ILE . 3.3 tm? -67.15 -43.4 82.4 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.089 0.471 . . . . 74.41 109.926 176.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.55 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -59.52 -45.06 92.85 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.006 -0.543 . . . . 62.2 112.029 178.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -64.79 -41.67 95.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.145 0.498 . . . . 73.51 110.683 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -64.25 -43.48 94.74 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.103 -0.499 . . . . 73.44 111.725 -177.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.6 m -66.67 -28.76 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 O-C-N 121.96 -0.462 . . . . 61.41 111.355 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 40.8 t -65.17 -25.81 67.89 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.259 0.552 . . . . 74.13 110.582 172.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.42 -37.46 17.0 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.826 -0.624 . . . . 74.14 111.14 174.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -77.22 -12.66 59.97 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.707 -0.679 . . . . 62.23 112.204 -174.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 37' ' ' ARG . 14.3 ptmm? -70.47 2.83 3.5 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.618 0.599 . . . . 74.41 112.618 -179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.71 67.4 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.105 0.478 . . . . 52.53 111.684 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -84.97 133.7 42.73 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.195 -0.457 . . . . 72.54 110.544 176.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -48.38 104.75 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 0.985 0 C-N-CA 122.646 2.23 . . . . 63.32 112.171 176.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 33' ' ' LYS . 16.8 mmm180 -78.43 -78.3 0.15 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.528 0.566 . . . . 74.42 112.528 -170.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.403 ' HA ' ' CB ' ' A' ' 4' ' ' ASP . 3.6 mm? 52.38 33.98 14.09 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 121.428 0.632 . . . . 72.0 110.747 -174.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.629 ' HB2' HD11 ' A' ' 45' ' ' ILE . 7.1 pt-20 -72.39 -62.77 1.32 Allowed 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.337 -0.847 . . . . 72.1 113.056 -170.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.598 ' HG3' ' H ' ' A' ' 41' ' ' ARG . 14.7 pt-20 42.54 -68.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 114.935 1.457 . . . . 63.23 114.935 -175.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.598 ' H ' ' HG3' ' A' ' 40' ' ' GLU . 60.9 mtp180 -62.15 122.15 14.85 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 121.132 0.492 . . . . 74.42 111.653 -176.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.587 ' HB2' ' SD ' ' A' ' 70' ' ' MET . 20.4 m170 -70.97 -14.76 62.47 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.185 0.809 . . . . 73.51 113.185 -171.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -62.13 1.89 Allowed 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 120.797 0.332 . . . . 73.0 110.34 179.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 31.8 m -56.15 -28.81 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 116.323 -0.398 . . . . 72.12 111.785 -178.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.629 HD11 ' HB2' ' A' ' 39' ' ' GLU . 49.4 mm -55.96 -51.94 55.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 116.505 -0.316 . . . . 74.41 111.008 176.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 35.5 ttp180 -57.99 -38.3 75.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.804 0.335 . . . . 71.42 111.337 -178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -51.7 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.119 0.485 . . . . 60.02 111.491 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -68.06 -37.25 81.08 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.831 0.678 . . . . 75.31 112.831 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.574 HG11 HG21 ' A' ' 62' ' ' THR . 33.1 m -67.47 -39.92 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 122.014 -0.429 . . . . 73.51 111.592 179.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 86.9 mtp -67.48 -25.63 65.97 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.169 0.509 . . . . 70.2 111.132 175.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.7 t -79.42 -42.38 25.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.048 -0.524 . . . . 65.3 111.81 177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -92.31 -59.2 2.15 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.609 0.596 . . . . 73.24 112.609 -174.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -76.72 101.7 5.91 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.237 0.541 . . . . 70.31 111.637 -173.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.8 p -83.36 -12.3 56.68 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 116.145 -0.48 . . . . 45.55 111.961 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -76.77 129.72 36.68 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.107 0.48 . . . . 62.52 111.728 -179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.448 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 11.9 t-160 -59.6 -41.61 90.72 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.261 0.467 . . . . 71.35 112.261 -176.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -66.23 -38.46 87.98 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.772 0.32 . . . . 75.24 111.638 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 74.4 mt -61.35 -43.22 99.24 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.122 0.487 . . . . 43.02 110.628 174.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 69.8 mt -63.68 -46.93 93.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.096 -0.502 . . . . 74.04 111.238 176.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 56' ' ' HIS . 46.7 mm-40 -51.71 -53.72 36.12 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.195 0.522 . . . . 70.23 111.336 177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.6 m -56.48 -49.36 74.89 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.695 -0.684 . . . . 53.54 111.528 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.574 HG21 HG11 ' A' ' 49' ' ' VAL . 82.8 m -64.91 -58.55 5.85 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.933 0.716 . . . . 64.24 112.933 -175.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -57.71 -38.12 74.71 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-O 121.127 0.489 . . . . 44.31 111.594 -172.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.8 ttm180 -70.75 -39.37 73.33 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.157 -0.474 . . . . 75.32 111.229 -178.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.61 98.25 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.119 0.485 . . . . 73.3 111.026 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.03 -47.64 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-N 115.984 -0.553 . . . . 72.22 110.978 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.9 t -49.21 -48.15 45.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.051 0.453 . . . . 65.03 111.157 176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.84 -56.83 16.55 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.116 -0.493 . . . . 74.21 111.637 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -80.19 19.0 0.78 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.275 0.843 . . . . 74.03 113.275 -175.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.587 ' SD ' ' HB2' ' A' ' 42' ' ' HIS . 93.6 mmm -120.07 -57.75 1.92 Allowed 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.968 -0.382 . . . . 62.22 109.968 167.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.69 -47.3 82.73 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 116.308 -0.405 . . . . 53.31 111.759 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -62.29 -41.61 98.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.818 0.342 . . . . 72.23 111.14 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 56.0 tp -62.08 -55.64 26.97 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.901 0.381 . . . . 64.11 111.153 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -55.67 -48.5 74.95 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.181 0.515 . . . . 70.43 111.006 177.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -63.8 -24.79 67.9 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.018 -0.537 . . . . 75.3 111.603 -179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -87.67 -10.66 50.65 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.188 0.44 . . . . 62.2 112.188 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -54.9 -39.77 69.11 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 75.32 111.334 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -165.52 -65.01 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.141 0.496 . . . . 71.43 110.555 175.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -176.51 102.26 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.818 -0.628 . . . . 74.54 109.958 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 . . . . . 0 C--O 1.255 1.374 0 CA-C-N 116.056 -0.52 . . . . 71.53 111.094 -173.667 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtm . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 120.714 0.292 . . . . 75.51 111.128 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -177.43 -172.5 0.38 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.91 0.386 . . . . 61.22 111.203 -178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.401 ' O ' ' HD3' ' A' ' 5' ' ' PRO . . . 92.54 -63.1 2.31 Favored Glycine 0 CA--C 1.523 0.55 0 C-N-CA 121.312 -0.47 . . . . 65.34 114.101 175.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -63.55 113.07 8.51 Favored Pre-proline 0 CA--C 1.545 0.77 0 N-CA-C 113.622 0.971 . . . . 74.41 113.622 -173.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 3' ' ' GLY . 92.0 Cg_endo -102.51 10.15 0.4 Allowed 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 123.669 2.913 . . . . 74.35 112.435 169.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.596 ' HB3' ' HB3' ' A' ' 9' ' ' TYR . 3.9 mmt 58.13 55.58 5.09 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.792 0.437 . . . . 64.21 111.877 -175.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 67.7 p -56.2 -59.17 5.32 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.186 0.439 . . . . 70.22 112.186 -178.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -64.35 -47.47 79.22 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 120.941 0.401 . . . . 75.42 111.655 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.596 ' HB3' ' HB3' ' A' ' 6' ' ' MET . 68.2 t80 -60.01 -41.52 92.32 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.129 -0.487 . . . . 74.32 112.279 -175.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -56.58 -27.81 58.8 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.212 0.449 . . . . 73.44 112.212 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -93.64 -50.34 5.44 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.628 0.251 . . . . 74.32 111.624 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 26' ' ' ALA . 11.0 tp -60.23 -31.95 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 N-CA-C 111.854 0.316 . . . . 74.23 111.854 -176.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.403 ' C ' ' SD ' ' A' ' 13' ' ' MET . 4.2 ppp? -61.55 -20.58 63.43 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.918 0.39 . . . . 64.2 111.35 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' ND2' ' A' ' 17' ' ' ASN . . . -58.96 -29.83 65.62 Favored Glycine 0 CA--C 1.528 0.868 0 C-N-CA 121.321 -0.466 . . . . 70.22 112.893 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -84.28 -11.57 56.19 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.909 0.385 . . . . 71.4 111.232 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 26' ' ' ALA . 54.1 tp60 -89.49 -19.26 25.3 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.182 -0.463 . . . . 60.3 111.155 178.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.403 ' ND2' ' HA2' ' A' ' 14' ' ' GLY . 86.7 m-20 -51.92 -41.97 62.42 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.002 0.43 . . . . 60.32 110.986 175.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -116.25 138.51 51.24 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.312 -0.404 . . . . 74.31 110.031 172.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -62.41 92.04 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.371 0.605 . . . . 72.24 112.09 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.1 p -118.0 154.14 51.37 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-N 115.873 -0.603 . . . . 64.42 111.092 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.95 -23.94 37.06 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.432 2.088 . . . . 43.05 112.713 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -83.75 -36.44 23.64 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.259 -0.428 . . . . 74.51 111.05 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -56.86 -30.53 60.07 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 116.161 -0.472 . . . . 65.42 113.271 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 43.8 mm -49.27 -40.43 13.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.214 0.531 . . . . 75.34 111.196 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 58' ' ' LEU . 3.3 tm? -62.09 -44.34 96.86 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.124 -0.489 . . . . 61.41 110.017 176.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.591 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.73 -43.18 98.22 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.23 -0.441 . . . . 32.35 111.812 178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.8 -34.14 77.16 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.924 0.392 . . . . 63.21 111.041 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -69.38 -45.75 68.58 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.623 0.249 . . . . 75.54 111.425 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.0 m -68.37 -30.94 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.01 0.433 . . . . 72.4 110.696 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.454 ' O ' ' HG2' ' A' ' 33' ' ' LYS . 34.2 t -61.78 -24.81 67.08 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.273 0.559 . . . . 75.43 110.965 173.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -76.69 -21.39 55.44 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.933 -0.576 . . . . 74.41 111.441 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -113.25 0.26 14.81 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 112.436 0.532 . . . . 74.34 112.436 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 30' ' ' SER . 0.0 OUTLIER -75.35 31.69 0.1 Allowed 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.607 -0.683 . . . . 71.13 112.636 -179.16 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.13 -39.19 23.65 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.065 0.395 . . . . 54.31 112.065 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -120.72 120.39 29.59 Favored Pre-proline 0 N--CA 1.471 0.576 0 CA-C-N 116.525 -0.307 . . . . 64.0 111.803 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.27 85.12 0.7 Allowed 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.242 1.962 . . . . 53.04 111.881 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.42 ' HB2' ' OE1' ' A' ' 39' ' ' GLU . 17.2 mmm180 -68.82 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 116.052 -0.522 . . . . 75.45 111.372 -178.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.4 pp -158.05 13.79 0.21 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.495 0.664 . . . . 74.34 110.376 171.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.499 ' HB3' HD11 ' A' ' 45' ' ' ILE . 5.4 mp0 -83.78 9.27 12.3 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.382 -0.826 . . . . 74.51 112.111 -176.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -66.37 -6.7 15.23 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 120.88 0.371 . . . . 74.21 111.73 179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.446 ' O ' HG22 ' A' ' 44' ' ' VAL . 0.2 OUTLIER -111.82 123.44 50.24 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.734 0.414 . . . . 73.55 110.491 -178.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.0 m80 -51.43 -36.16 42.67 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.088 0.403 . . . . 73.02 112.088 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -52.46 -48.94 65.56 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 116.215 -0.448 . . . . 54.34 112.137 179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 41' ' ' ARG . 30.7 m -79.08 -24.99 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 111.922 0.342 . . . . 72.01 111.922 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.499 HD11 ' HB3' ' A' ' 39' ' ' GLU . 25.0 mm -59.12 -47.3 90.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-O 120.813 0.34 . . . . 73.33 111.003 175.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -53.04 -43.95 67.02 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.345 -0.388 . . . . 71.13 111.393 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -74.9 -40.94 60.61 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.998 0.428 . . . . 72.14 111.431 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -61.13 -45.37 94.94 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.255 -0.429 . . . . 73.25 111.777 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.734 HG11 HG21 ' A' ' 62' ' ' THR . 35.5 m -63.0 -39.51 85.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 O-C-N 122.368 -0.207 . . . . 64.1 111.527 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.4 mtm -70.66 -13.47 62.09 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.055 0.455 . . . . 74.15 111.278 177.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.9 t -91.67 -2.92 56.85 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.385 -0.371 . . . . 71.24 111.763 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -133.65 -53.2 0.88 Allowed 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 120.968 0.413 . . . . 72.25 111.701 -178.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -84.92 144.84 28.1 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.986 0.422 . . . . 75.11 111.548 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 76.4 p -118.75 -48.64 2.47 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.1 0.407 . . . . 73.14 112.1 -178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -51.25 144.53 9.41 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 113.159 0.8 . . . . 62.24 113.159 -177.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -50.41 -55.92 13.68 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.064 -0.971 . . . . 72.45 112.726 -174.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.55 -39.21 79.59 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.347 0.499 . . . . 73.03 112.347 -175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 25' ' ' LEU . 89.2 mt -58.47 -41.36 85.07 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.054 0.391 . . . . 52.13 112.054 -177.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 48.9 mm -85.36 -40.31 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.958 0.409 . . . . 64.12 111.505 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -55.89 -53.71 53.47 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.569 0.581 . . . . 71.42 112.569 -177.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 53.7 m -64.2 -43.95 93.46 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.787 0.327 . . . . 61.23 111.457 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 49' ' ' VAL . 57.8 m -58.44 -49.16 78.3 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.309 0.485 . . . . 74.23 112.309 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -52.9 -35.01 57.55 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.045 0.45 . . . . 64.25 111.809 -177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.449 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 29.8 ttm180 -63.79 -51.27 65.57 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.184 -0.462 . . . . 74.04 110.98 177.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.99 -21.37 63.48 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 116.044 -0.526 . . . . 71.03 112.002 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 62' ' ' THR . 46.7 mm -74.69 -54.75 13.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 CA-C-O 121.079 0.466 . . . . 65.3 111.316 176.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -63.11 -38.84 92.77 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.805 -0.634 . . . . 63.44 112.262 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 94.0 mt -53.84 -63.9 1.0 Allowed 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.626 0.602 . . . . 72.35 112.626 -177.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -78.31 22.28 0.33 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.895 0.702 . . . . 63.52 112.895 -177.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 84.0 mtp -130.56 -68.7 0.68 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.744 0.307 . . . . 75.51 110.673 172.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.49 -44.39 78.62 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.165 0.431 . . . . 45.24 112.165 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.512 ' HB3' ' O ' ' A' ' 68' ' ' LEU . 47.6 t-20 -66.6 -39.16 88.24 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 121.076 0.465 . . . . 73.04 110.642 179.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.28 -58.45 7.67 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.026 -0.534 . . . . 65.13 110.628 177.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 77' ' ' HIS . 11.8 pt-20 -65.69 -26.11 67.63 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.607 -0.269 . . . . 71.24 111.694 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -63.73 -40.89 97.86 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.157 -0.34 . . . . 72.21 110.402 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -66.25 -31.12 71.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.788 0.328 . . . . 73.54 111.295 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 82.9 t60 -58.62 -35.26 72.19 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.035 0.445 . . . . 75.35 110.507 174.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -88.63 90.56 8.45 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.234 -0.439 . . . . 71.14 110.456 173.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -65.61 -16.82 64.09 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.228 0.537 . . . . 75.35 110.937 177.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.494 -0.765 . . . . 74.55 110.592 175.632 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.8 tpp . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.913 0.387 . . . . 74.13 111.511 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.41 -173.7 3.92 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.189 0.519 . . . . 51.2 111.562 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.419 ' O ' ' HD3' ' A' ' 5' ' ' PRO . . . -141.29 152.55 23.38 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 121.192 -0.528 . . . . 45.45 112.466 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -96.06 100.95 7.36 Favored Pre-proline 0 CA--C 1.545 0.755 0 CA-C-O 120.961 0.41 . . . . 74.41 111.53 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HB2' HG23 ' A' ' 7' ' ' THR . 74.0 Cg_endo -76.96 -26.83 7.5 Favored 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.282 1.988 . . . . 74.23 112.75 -179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm 54.87 20.7 3.22 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.099 0.407 . . . . 71.43 112.099 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.457 HG23 ' HB2' ' A' ' 5' ' ' PRO . 40.7 p -73.88 25.64 0.07 Allowed 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.228 0.825 . . . . 75.1 113.228 -174.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.458 ' CZ ' HG23 ' A' ' 62' ' ' THR . 77.5 t80 -119.61 -60.79 1.69 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 109.461 -0.57 . . . . 52.23 109.461 169.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -60.74 -27.18 67.75 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 115.9 -0.591 . . . . 65.43 110.738 175.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -55.17 -39.74 69.88 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.28 -0.418 . . . . 74.41 111.883 178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.548 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 79.2 t80 -68.05 -52.41 35.68 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.171 0.51 . . . . 65.33 111.334 178.074 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.759 HG13 ' HB2' ' A' ' 26' ' ' ALA . 9.1 tp -82.69 -3.6 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 CA-C-N 115.905 -0.589 . . . . 64.22 111.766 -173.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.597 ' SD ' ' N ' ' A' ' 14' ' ' GLY . 0.0 OUTLIER -58.8 143.34 47.56 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.756 0.312 . . . . 63.32 110.441 177.059 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.597 ' N ' ' SD ' ' A' ' 13' ' ' MET . . . 98.51 -40.1 2.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.998 -0.62 . . . . 42.54 112.03 -173.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 92.8 m-85 -70.32 -22.39 62.82 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.772 0.32 . . . . 71.54 111.023 175.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.1 OUTLIER -69.65 66.11 0.21 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.52 0.676 . . . . 72.21 109.28 173.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 t30 176.21 -43.55 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.376 -0.829 . . . . 74.15 110.466 -171.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -95.59 144.56 25.94 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 121.287 0.565 . . . . 75.53 112.099 -179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -82.11 80.78 8.26 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.252 0.548 . . . . 62.23 111.611 -178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.8 p -133.14 158.6 75.37 Favored Pre-proline 0 N--CA 1.473 0.724 0 CA-C-N 116.275 -0.421 . . . . 54.15 110.627 177.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.21 -29.44 29.26 Favored 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 122.426 2.084 . . . . 73.12 112.69 175.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 12' ' ' ILE . 88.2 m-85 -80.78 -38.14 29.04 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 115.977 -0.556 . . . . 75.33 110.779 175.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' ' HB3' ' A' ' 15' ' ' PHE . . . -61.56 -36.48 92.68 Favored Glycine 0 CA--C 1.523 0.586 0 C-N-CA 121.388 -0.434 . . . . 71.0 112.909 176.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 68.1 mt -54.71 -49.6 67.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.212 0.529 . . . . 53.23 110.994 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 58' ' ' LEU . 3.4 tm? -62.13 -51.35 68.22 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.665 -0.698 . . . . 73.53 110.623 177.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -51.26 -42.62 61.19 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.304 0.573 . . . . 61.22 111.952 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.56 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 42.2 tt0 -70.11 -40.54 74.85 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.81 -0.632 . . . . 64.44 111.573 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -75.26 -30.32 60.44 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.26 0.467 . . . . 74.13 112.26 -175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.7 m -77.48 -21.11 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 O-C-N 121.967 -0.458 . . . . 34.5 111.677 177.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 32.4 t -99.14 21.5 11.72 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 121.213 0.53 . . . . 45.11 110.589 176.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -75.67 -37.77 59.29 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.807 -0.633 . . . . 71.33 112.367 -177.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.9 -166.68 1.12 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-O 120.71 0.291 . . . . 72.21 111.253 -175.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.551 ' HB3' ' CD2' ' A' ' 35' ' ' PHE . 34.0 mtmm -50.19 -36.76 31.9 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.381 0.882 . . . . 71.34 113.381 -178.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 66.32 23.0 10.78 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.273 0.842 . . . . 71.44 113.273 175.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 33' ' ' LYS . 67.4 m-85 -76.82 137.22 66.36 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 122.266 -0.271 . . . . 60.23 110.84 175.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -69.42 146.37 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.612 2.208 . . . . 64.01 113.313 -177.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.7 mmm180 -107.52 -64.11 1.23 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 120.913 0.387 . . . . 74.35 111.496 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 38' ' ' LEU . 8.2 tt -157.04 0.9 0.12 Allowed 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 121.442 0.639 . . . . 71.24 110.972 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -74.43 84.14 1.97 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.054 -0.521 . . . . 64.02 112.269 -170.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -87.68 -53.5 4.75 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.133 0.492 . . . . 73.41 109.938 176.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -74.26 150.3 40.32 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.208 -0.451 . . . . 73.04 111.186 177.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.691 ' HB3' HD12 ' A' ' 66' ' ' ILE . 77.4 m80 -96.22 -18.93 19.7 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.707 1.003 . . . . 62.11 113.707 -171.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -42.25 86.48 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.944 -0.473 . . . . 71.04 110.726 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 30.7 m -56.14 -24.57 18.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 112.542 0.571 . . . . 63.44 112.542 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.6 mm -64.25 -29.72 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 121.116 0.484 . . . . 51.3 111.036 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.9 ttm180 -59.37 -46.49 88.51 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.198 -0.456 . . . . 72.42 111.384 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.61 69.78 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.895 0.378 . . . . 51.14 111.539 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -50.93 -51.89 47.69 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 121.077 0.465 . . . . 62.05 112.163 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.504 HG11 HG21 ' A' ' 62' ' ' THR . 28.1 m -73.26 -25.56 21.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 112.72 0.637 . . . . 73.24 112.72 -178.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 46' ' ' ARG . 86.1 mtp -64.23 -21.7 66.68 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.021 0.438 . . . . 74.1 111.688 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.1 t -96.02 -29.93 13.86 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.187 0.44 . . . . 75.12 112.187 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -97.11 -45.03 6.71 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.92 0.711 . . . . 73.22 112.92 -175.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' A' ' 58' ' ' LEU . 20.6 m-30 -94.85 144.17 25.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 112.901 0.704 . . . . 73.11 112.901 -172.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 66.6 p -109.17 -36.3 6.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.537 -0.756 . . . . 53.24 111.363 177.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 59' ' ' ILE . 7.2 m-20 -65.08 127.2 30.67 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.099 0.407 . . . . 73.14 112.099 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -56.09 -39.58 72.33 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 112.155 0.428 . . . . 74.41 112.155 -176.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.575 ' H ' ' NE2' ' A' ' 57' ' ' GLN . 2.1 mp0 -64.09 -28.06 69.52 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.905 0.383 . . . . 63.53 111.375 179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.447 ' HA ' HD23 ' A' ' 25' ' ' LEU . 88.9 mt -84.97 -29.02 25.4 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.914 0.388 . . . . 65.11 111.19 176.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 55' ' ' ASP . 73.2 mt -76.26 -64.88 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.44 -0.346 . . . . 65.34 111.875 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.56 ' HA ' HD21 ' A' ' 63' ' ' ASN . 33.6 tt0 -61.06 -56.2 23.72 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.448 0.536 . . . . 43.24 112.448 -173.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.3 m -43.54 -45.85 6.77 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 112.07 0.396 . . . . 72.1 112.07 -177.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.504 HG21 HG11 ' A' ' 49' ' ' VAL . 92.6 m -58.87 -63.29 1.35 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.192 -0.458 . . . . 53.5 112.042 178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.56 HD21 ' HA ' ' A' ' 60' ' ' GLU . 9.6 p30 -71.74 -12.33 61.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.081 0.467 . . . . 62.21 111.609 -175.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -82.62 -42.62 17.99 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.811 177.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.47 -37.99 76.64 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.164 0.507 . . . . 73.54 111.534 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.691 HD12 ' HB3' ' A' ' 42' ' ' HIS . 46.2 mm -54.43 -38.08 39.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 115.681 -0.691 . . . . 74.34 111.415 177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.9 t -59.39 -42.33 91.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.955 -0.566 . . . . 71.42 111.842 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -58.98 -49.7 76.89 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.62 0.248 . . . . 42.23 111.244 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.548 ' CE2' ' HB2' ' A' ' 11' ' ' PHE . 16.3 m-85 -62.01 -55.21 31.55 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 112.039 0.385 . . . . 62.41 112.039 177.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 83.7 mtp -59.66 -43.72 93.83 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.09 0.404 . . . . 70.34 112.09 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.96 -42.29 97.32 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 111.987 0.366 . . . . 75.23 111.987 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -71.52 -48.22 50.23 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.867 0.365 . . . . 75.12 111.032 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.76 -47.46 82.42 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 116.149 -0.478 . . . . 70.03 111.311 -177.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -60.91 -38.22 84.95 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.91 0.337 . . . . 74.41 111.91 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -84.55 -21.23 30.54 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.649 0.261 . . . . 73.25 111.68 -178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -78.25 -45.01 23.98 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.926 0.393 . . . . 75.24 110.866 174.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 -70.95 -50.86 29.94 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 109.696 -0.483 . . . . 73.23 109.696 175.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 56.5 t60 46.64 113.52 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.829 1.418 . . . . 74.31 114.829 170.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -167.24 -33.42 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.812 -0.631 . . . . 53.54 110.89 176.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.402 -0.809 . . . . 70.25 110.89 176.589 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.5 ttm . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.42 0.152 . . . . 74.43 110.965 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 175.75 175.43 0.26 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.77 0.428 . . . . 72.21 111.02 -177.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.41 62.82 3.74 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 121.288 -0.482 . . . . 40.12 112.668 176.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.9 t0 55.13 90.99 0.08 OUTLIER Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 123.747 0.819 . . . . 72.22 112.229 -176.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -92.87 3.53 3.5 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.987 2.458 . . . . 44.03 113.321 177.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 60.6 mtm -111.89 10.48 20.67 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.14 0.422 . . . . 74.31 112.14 -174.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.8 p -44.08 -47.2 8.85 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.04 0.756 . . . . 61.53 113.04 178.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.481 ' HE2' HG11 ' A' ' 29' ' ' VAL . 89.3 t80 -54.12 -50.58 66.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 120.935 0.397 . . . . 75.35 111.229 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -66.07 -40.79 91.17 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.297 -0.411 . . . . 71.44 110.947 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -61.85 -23.25 66.15 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.986 0.422 . . . . 53.43 111.516 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.518 ' HB2' ' OH ' ' A' ' 69' ' ' TYR . 57.2 t80 -80.27 -52.65 7.46 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.974 0.416 . . . . 75.54 111.11 177.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.704 HG13 ' HB2' ' A' ' 26' ' ' ALA . 10.5 tp -76.43 -13.68 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.234 -0.439 . . . . 62.32 111.822 -176.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.9 ttp -58.8 137.46 57.7 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.007 0.432 . . . . 61.32 111.15 176.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.18 -45.86 1.28 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.239 -0.505 . . . . 35.43 112.314 -174.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -63.38 -27.25 69.17 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.184 0.516 . . . . 74.11 111.011 176.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.475 ' HA ' ' HA2' ' A' ' 23' ' ' GLY . 0.1 OUTLIER -57.01 -28.7 62.7 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.762 -0.654 . . . . 74.52 111.26 178.707 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -67.29 -31.38 71.65 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.171 0.434 . . . . 54.34 112.171 -176.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -106.76 129.43 54.63 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.405 0.622 . . . . 60.22 111.596 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.46 90.15 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.588 0.709 . . . . 73.33 111.469 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 21' ' ' PRO . 68.6 p -141.18 168.07 15.29 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 115.295 -0.866 . . . . 71.41 110.826 -178.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 20' ' ' THR . 81.6 Cg_exo -48.1 -36.17 27.78 Favored 'Trans proline' 0 C--N 1.355 0.873 0 C-N-CA 122.257 1.971 . . . . 54.04 112.169 170.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -71.82 -44.82 63.26 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.775 -0.648 . . . . 71.54 110.7 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 16' ' ' GLN . . . -58.13 -41.29 94.59 Favored Glycine 0 CA--C 1.524 0.654 0 CA-C-N 116.013 -0.54 . . . . 70.51 113.143 177.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 47.1 mm -62.86 -45.0 99.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 120.686 0.279 . . . . 70.33 111.211 177.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.98 -51.85 67.96 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.878 0.37 . . . . 75.43 110.497 177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.704 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -58.83 -44.71 90.96 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.221 0.534 . . . . 64.04 111.846 179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -65.04 -37.27 87.04 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.025 0.441 . . . . 61.1 111.405 178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -68.84 -44.12 74.06 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.501 -0.318 . . . . 65.23 111.496 -178.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.481 HG11 ' HE2' ' A' ' 8' ' ' PHE . 32.6 m -69.1 -24.75 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-O 120.82 0.343 . . . . 71.25 111.508 178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 41.9 t -65.65 -23.24 66.75 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.982 0.42 . . . . 62.23 111.27 174.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -75.63 -15.49 60.33 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.309 -0.405 . . . . 73.23 111.465 177.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -81.85 -162.42 0.53 Allowed 'General case' 0 CA--C 1.554 1.102 0 CA-C-O 120.876 0.37 . . . . 71.2 111.884 -174.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -59.25 -36.26 75.17 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 112.829 0.677 . . . . 53.3 112.829 -175.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 68.12 5.62 4.75 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.839 0.456 . . . . 71.32 112.194 -177.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -125.14 151.13 68.84 Favored Pre-proline 0 N--CA 1.469 0.489 0 C-N-CA 122.748 0.419 . . . . 75.13 110.268 177.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.01 104.81 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 123.135 2.557 . . . . 65.0 113.82 -176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -94.61 -72.23 0.63 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.224 -0.444 . . . . 70.52 110.641 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 83.3 mt -138.16 14.29 2.83 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 116.211 -0.45 . . . . 74.12 111.705 -179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.416 ' HG3' HD11 ' A' ' 45' ' ' ILE . 4.4 mp0 -78.36 44.16 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.927 0.714 . . . . 53.12 112.927 -173.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -81.73 -66.95 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.891 -0.506 . . . . 73.04 111.846 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -93.24 2.2 56.73 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.697 0.628 . . . . 75.12 112.697 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 66' ' ' ILE . 46.5 m80 73.87 -52.79 0.69 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.471 0.915 . . . . 73.22 113.471 172.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -48.94 -35.16 14.36 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.164 0.801 . . . . 73.45 113.164 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.7 m -56.67 -36.91 50.3 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 112.031 0.382 . . . . 74.05 112.031 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.416 HD11 ' HG3' ' A' ' 39' ' ' GLU . 67.4 mt -58.02 -41.48 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.045 0.45 . . . . 72.24 111.214 179.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.48 ' O ' ' HD2' ' A' ' 46' ' ' ARG . 3.6 tmm_? -61.45 -31.77 71.74 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.007 -0.542 . . . . 65.23 110.631 -178.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.04 -50.14 37.2 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.935 0.398 . . . . 75.13 111.342 176.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -60.91 -41.28 95.83 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.433 0.531 . . . . 71.3 112.433 -178.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.674 HG11 HG21 ' A' ' 62' ' ' THR . 33.7 m -62.95 -31.67 53.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 112.106 0.41 . . . . 74.22 112.106 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.41 ' HB2' ' HE2' ' A' ' 50' ' ' MET . 60.6 mtm -70.93 -18.08 62.66 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.936 0.398 . . . . 71.13 111.316 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 t -100.95 -30.91 11.38 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.099 0.407 . . . . 74.25 112.099 178.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -92.45 -33.41 14.53 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.661 0.615 . . . . 71.14 112.661 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -106.02 146.64 29.83 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.224 0.535 . . . . 71.33 111.441 -178.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.3 p -112.57 -26.17 8.79 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.088 -0.505 . . . . 74.33 112.101 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -87.84 152.8 21.82 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.872 0.693 . . . . 74.11 112.872 -174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -61.75 -50.34 72.78 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.407 -0.815 . . . . 70.43 112.667 -178.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -55.88 -38.52 70.26 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.104 0.409 . . . . 74.42 112.104 -174.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.3 mt -72.73 -43.73 62.59 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.164 0.431 . . . . 70.55 112.164 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 65.8 mt -77.55 -51.37 18.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 112.14 0.422 . . . . 52.54 112.14 -176.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.691 ' HA ' HD21 ' A' ' 63' ' ' ASN . 3.2 tm-20 -55.47 -51.24 67.6 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 122.907 0.483 . . . . 73.32 111.598 -176.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.1 m -57.74 -38.07 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.864 0.364 . . . . 65.23 111.907 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.674 HG21 HG11 ' A' ' 49' ' ' VAL . 89.2 m -63.72 -58.02 8.16 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.226 0.454 . . . . 73.03 112.226 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.691 HD21 ' HA ' ' A' ' 60' ' ' GLU . 9.4 p30 -62.21 -31.88 72.47 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 121.119 0.485 . . . . 70.2 110.848 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.5 ttt180 -57.6 -55.59 32.89 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.585 -0.734 . . . . 73.42 110.825 175.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.27 -48.39 74.08 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.048 -0.524 . . . . 74.1 111.974 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 42' ' ' HIS . 49.6 mm -57.75 -37.95 62.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 116.376 -0.375 . . . . 73.21 111.777 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 t -62.48 -36.85 83.78 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.744 0.307 . . . . 72.44 111.506 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.35 -0.8 13.31 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 112.122 0.415 . . . . 75.54 112.122 178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 11' ' ' PHE . 51.9 m-85 -106.31 -54.59 2.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.716 0.293 . . . . 65.43 111.056 172.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.44 -67.71 0.42 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 111.949 0.352 . . . . 63.33 111.949 -176.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -59.04 -28.59 66.58 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.137 0.494 . . . . 73.54 112.063 -178.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -73.92 -50.21 21.17 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.269 -0.423 . . . . 52.42 111.091 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -55.45 -51.48 66.78 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 120.972 0.415 . . . . 62.14 110.259 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -54.32 -42.62 70.36 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.087 -0.506 . . . . 72.05 111.791 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -68.57 -28.05 66.61 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.191 0.441 . . . . 75.42 112.191 -177.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -85.74 -42.13 14.5 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.836 0.35 . . . . 63.13 111.797 179.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -73.53 -38.11 65.39 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 121.066 -0.254 . . . . 72.44 111.308 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -74.13 96.9 2.81 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.053 0.454 . . . . 73.43 109.94 174.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 80' ' ' HIS . 66.0 t60 -56.16 -23.13 33.03 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.669 0.618 . . . . 72.43 112.669 -173.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 79' ' ' HIS . 54.4 t-80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.475 -0.774 . . . . 54.33 110.96 -176.727 . . . . . . . . 1 1 . 1 stop_ save_