data_1st7_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 1st7 _Structure_validation_residue.Date_analyzed 2017-03-24 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 full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 CA--C 1.49 -1.351 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 m -75.45 6.87 4.1 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.441 2.696 . . . . 0.0 114.654 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -71.02 -51.49 25.07 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.775 -1.828 . . . . 0.0 111.005 175.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.496 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -68.39 -27.58 66.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.265 1.826 . . . . 0.0 111.785 178.216 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 58.3 t80 -56.69 -50.56 71.77 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 123.911 0.884 . . . . 0.0 110.342 168.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -79.87 -11.99 59.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.092 -1.63 . . . . 0.0 113.729 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -66.09 -57.99 6.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.431 -2.043 . . . . 0.0 111.523 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.9 mttm -81.09 -36.42 30.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.66 -1.609 . . . . 0.0 113.715 -169.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.403 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.89 -39.57 76.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.578 -1.951 . . . . 0.0 114.079 -173.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -65.3 -20.79 66.57 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.593 1.557 . . . . 0.0 113.27 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.28 -50.24 11.22 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.039 -1.038 . . . . 0.0 111.878 171.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 30.8 m -66.56 -21.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.024 -1.672 . . . . 0.0 113.473 -175.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 172.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -142.86 25.08 1.81 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.722 -1.236 . . . . 0.0 113.297 -173.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 tp -70.24 153.94 94.87 Favored Pre-proline 0 N--CA 1.43 -1.427 0 C-N-CA 125.965 1.706 . . . . 0.0 110.1 177.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.24 -21.22 17.95 Favored 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 124.113 2.505 . . . . 0.0 111.17 -173.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 m -102.46 74.74 1.41 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 104.065 -2.568 . . . . 0.0 104.065 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -58.11 150.78 49.73 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -175.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 140.19 85.45 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 123.087 2.525 . . . . 0.0 115.329 -164.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.1 m -73.61 159.52 32.96 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.825 1.25 . . . . 0.0 113.213 -177.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.8 t -55.69 -47.6 76.49 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 -160.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.26 -21.33 27.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.401 -2.062 . . . . 0.0 112.749 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -72.86 -36.94 67.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.673 1.589 . . . . 0.0 112.334 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 tp -52.13 -40.61 61.6 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.85 2.86 . . . . 0.0 116.22 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . 0.344 1.3 tm? -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.619 1.968 . . . . 0.0 114.434 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -64.26 -47.27 80.22 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.074 0.949 . . . . 0.0 110.303 174.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.66 -37.34 85.99 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -58.35 -57.15 14.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.274 2.306 . . . . 0.0 111.295 167.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.22 -51.42 54.15 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 119.664 1.12 . . . . 0.0 113.716 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.1 -37.61 64.1 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.338 1.606 . . . . 0.0 115.338 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.403 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 49.8 t80 -62.31 -52.98 61.49 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.115 -2.241 . . . . 0.0 111.289 174.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -59.04 -37.96 78.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.038 -2.289 . . . . 0.0 113.285 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -48.45 -61.46 2.0 Allowed 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 170.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.402 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -84.56 -21.14 30.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.682 -1.261 . . . . 0.0 112.743 -175.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.5 m -62.94 -63.27 1.26 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 113.005 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.51 -27.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.774 -1.204 . . . . 0.0 114.14 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.54 -13.27 67.02 Favored Glycine 0 N--CA 1.431 -1.674 0 O-C-N 120.307 -1.495 . . . . 0.0 116.084 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -144.92 164.08 32.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -53.0 111.5 0.68 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 153.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.96 -75.33 0.63 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.988 1.715 . . . . 0.0 111.619 -166.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 81.38 6.23 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.965 -1.709 . . . . 0.0 112.301 -174.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -79.49 52.42 1.38 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.084 1.421 . . . . 0.0 112.64 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -160.15 84.94 2.06 Favored Pre-proline 0 N--CA 1.43 -1.443 0 O-C-N 120.544 -1.347 . . . . 0.0 107.774 160.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.48 154.99 64.5 Favored 'Trans proline' 0 N--CA 1.434 -2.02 0 C-N-CA 122.295 1.997 . . . . 0.0 108.705 157.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.81 -170.33 32.25 Favored Glycine 0 N--CA 1.43 -1.702 0 N-CA-C 117.049 1.58 . . . . 0.0 117.049 -159.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 11.9 pt -90.58 -48.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.953 -1.322 . . . . 0.0 110.851 -156.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -90.65 1.16 57.05 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.993 2.117 . . . . 0.0 109.523 168.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.51 61.91 6.95 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.472 -1.393 . . . . 0.0 112.803 -166.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.07 72.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.949 1.7 . . . . 0.0 113.709 -177.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -61.95 -54.79 36.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.973 1.709 . . . . 0.0 111.455 173.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -66.92 -38.73 86.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.415 1.486 . . . . 0.0 110.987 -177.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -57.56 -36.55 71.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -71.37 -46.5 60.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.014 -1.679 . . . . 0.0 112.841 173.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -58.79 -45.0 90.87 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.228 1.411 . . . . 0.0 113.023 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -66.51 -31.25 71.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.409 1.483 . . . . 0.0 113.171 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.16 -41.55 73.67 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.297 -1.502 . . . . 0.0 111.277 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.04 -18.13 64.6 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.851 -1.156 . . . . 0.0 113.455 175.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -85.18 -50.61 7.25 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.959 1.704 . . . . 0.0 109.47 176.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -57.69 -22.56 46.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.84 2.856 . . . . 0.0 113.364 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -50.07 -32.46 15.7 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.686 1.594 . . . . 0.0 114.101 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.4 mp -115.84 17.93 15.85 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -31.09 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.42 1 N-CA-C 123.81 4.744 . . . . 0.0 123.81 -176.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -106.85 -40.24 1.88 Allowed Glycine 0 N--CA 1.429 -1.769 0 CA-C-N 120.243 1.383 . . . . 0.0 113.652 -176.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -95.8 -3.37 45.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.911 -1.346 . . . . 0.0 112.471 -172.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 m -26.78 -59.79 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 130.055 3.342 . . . . 0.0 118.68 -174.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.0 -38.99 73.85 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.1 -37.04 47.31 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.037 1.735 . . . . 0.0 111.807 -173.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.15 -37.88 19.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.997 -1.064 . . . . 0.0 110.342 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.12 -62.36 1.71 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -43.89 -32.63 1.14 Allowed 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 119.545 3.165 . . . . 0.0 119.545 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -88.39 -37.65 15.72 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.837 -2.414 . . . . 0.0 114.15 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -71.74 -27.0 62.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.735 -1.228 . . . . 0.0 111.151 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -73.32 -48.64 32.76 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.742 -0.599 . . . . 0.0 111.668 -159.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' HB ' HD12 ' A' ' 4' ' ' LEU . 18.5 tt -44.87 -48.16 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 171.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.93 -15.45 60.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.1 mt -76.09 -59.12 2.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.495 -1.378 . . . . 0.0 109.212 167.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.5 t -71.28 -27.16 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.515 -1.366 . . . . 0.0 111.779 -166.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.79 -37.21 84.12 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.193 -2.192 . . . . 0.0 114.032 176.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -79.56 -14.84 58.57 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.429 -1.42 . . . . 0.0 113.502 175.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.3 mt -81.2 -49.17 11.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.237 2.215 . . . . 0.0 110.358 172.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 68.3 mt -59.94 -31.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 119.181 -2.199 . . . . 0.0 112.695 174.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.13 -31.88 61.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 168.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -86.83 -35.38 19.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.075 -1.641 . . . . 0.0 109.904 174.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -104.38 -17.04 14.94 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.603 1.705 . . . . 0.0 115.603 -156.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.306 10.3 p -46.11 -56.43 5.63 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 116.574 2.065 . . . . 0.0 116.574 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.26 1.657 0 O-C-N 120.877 -1.139 . . . . 0.0 110.445 175.29 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -87.4 9.33 21.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.505 2.722 . . . . 0.0 115.371 -172.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -61.79 -46.88 87.61 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.374 -1.454 . . . . 0.0 110.957 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.471 HD22 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -70.97 -34.46 71.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.874 2.47 . . . . 0.0 112.251 175.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.442 ' CZ ' ' HB2' ' A' ' 34' ' ' ALA . 14.2 t80 -60.76 -51.94 67.21 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.834 1.254 . . . . 0.0 109.645 178.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -76.63 -21.34 55.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.041 -1.037 . . . . 0.0 111.594 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -53.77 46.26 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.681 -1.262 . . . . 0.0 113.329 166.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -86.36 -25.64 25.24 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 119.864 -1.773 . . . . 0.0 114.589 -173.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.493 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.83 -45.45 74.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 124.653 2.168 . . . . 0.0 114.009 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -58.37 -26.81 63.61 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.395 2.278 . . . . 0.0 113.442 170.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.97 -56.57 4.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 123.999 0.919 . . . . 0.0 110.943 171.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 25.1 m -63.24 -31.68 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 O-C-N 120.707 -1.245 . . . . 0.0 113.536 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -69.82 -26.6 64.32 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 176.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -107.87 -9.86 15.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.575 1.55 . . . . 0.0 112.851 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.01 151.06 81.62 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 127.946 2.498 . . . . 0.0 111.685 -172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.06 -18.34 21.35 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.392 2.061 . . . . 0.0 112.104 -169.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.3 m -106.1 79.18 1.38 Allowed 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 174.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -61.22 154.92 59.64 Favored Pre-proline 0 N--CA 1.431 -1.398 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -171.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -66.69 144.97 74.06 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 C-N-CA 122.698 2.265 . . . . 0.0 113.958 -168.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.7 t -78.38 144.52 35.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.7 m -41.19 -59.79 1.42 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 130.221 3.409 . . . . 0.0 117.417 -167.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -87.8 -13.4 42.33 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.605 -1.309 . . . . 0.0 112.349 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.12 -50.18 9.34 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.059 1.344 . . . . 0.0 110.042 175.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -42.21 -41.03 2.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 129.245 3.018 . . . . 0.0 115.442 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.28 -48.45 80.43 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -58.54 -43.49 89.27 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.648 1.579 . . . . 0.0 114.453 170.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.97 -40.46 96.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.614 1.966 . . . . 0.0 111.71 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -49.82 -49.01 50.46 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 128.268 2.627 . . . . 0.0 112.468 171.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -45.54 65.54 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.765 2.075 . . . . 0.0 114.857 175.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -71.74 -49.37 39.8 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.805 -1.184 . . . . 0.0 113.885 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.493 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.1 t80 -52.66 -52.85 53.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.344 2.257 . . . . 0.0 111.196 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.462 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.7 mmmt -62.25 -37.59 86.03 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.516 -1.365 . . . . 0.0 111.784 172.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -57.04 14.65 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.442 ' HB2' ' CZ ' ' A' ' 5' ' ' PHE 0.258 . . -89.78 -7.09 55.21 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 113.532 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -68.02 -61.01 2.06 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.976 -1.702 . . . . 0.0 112.635 166.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 m -87.33 -42.87 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.81 -22.87 38.38 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.685 -1.259 . . . . 0.0 114.047 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -125.67 159.89 31.08 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 178.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -55.8 107.69 0.37 Allowed 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 119.976 -1.703 . . . . 0.0 113.518 152.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -78.21 -62.3 1.72 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.989 -1.694 . . . . 0.0 111.179 -173.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.49 168.28 19.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.64 1.176 . . . . 0.0 109.022 169.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -146.08 29.08 1.09 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.956 1.836 . . . . 0.0 106.255 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -142.72 78.95 15.44 Favored Pre-proline 0 N--CA 1.43 -1.444 0 O-C-N 120.833 -1.167 . . . . 0.0 111.044 -168.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -77.41 168.56 22.65 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 C-N-CA 122.699 2.266 . . . . 0.0 110.242 160.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -154.33 6.2 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 120.413 2.925 . . . . 0.0 120.413 -168.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.434 HG13 ' H ' ' A' ' 47' ' ' PHE . 3.2 pt -104.12 -64.72 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 125.321 1.448 . . . . 0.0 110.631 -165.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.434 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.8 OUTLIER -84.18 -4.94 59.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.66 1.584 . . . . 0.0 111.392 168.506 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -76.3 69.32 2.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.189 2.195 . . . . 0.0 113.851 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 48.9 mtm -61.96 -39.7 93.02 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.22 1.408 . . . . 0.0 113.29 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -41.66 93.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 174.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.31 -49.41 64.27 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.429 -1.419 . . . . 0.0 111.606 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm-85 -45.5 -60.18 2.31 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.37 1.868 . . . . 0.0 115.533 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -72.92 -38.37 66.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 122.218 1.009 . . . . 0.0 112.687 -176.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -85.88 -13.64 47.28 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.242 -2.161 . . . . 0.0 113.563 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -68.75 -36.75 78.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.406 -1.434 . . . . 0.0 110.935 158.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -69.98 -26.36 64.06 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.465 -2.022 . . . . 0.0 112.551 175.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.89 -25.03 64.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.792 -1.192 . . . . 0.0 113.229 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.462 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 19.2 t90 -81.62 -46.72 13.99 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 125.311 1.444 . . . . 0.0 110.302 174.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.469 ' CD ' ' HZ3' ' A' ' 62' ' ' LYS . 30.2 tp10 -53.82 -30.35 44.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 128.894 2.878 . . . . 0.0 115.089 174.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -51.72 -31.87 28.06 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.618 -1.926 . . . . 0.0 113.45 167.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 65' ' ' SER . 46.5 mt -105.12 -1.93 24.92 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.355 1.462 . . . . 0.0 114.261 -173.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.469 ' HZ3' ' CD ' ' A' ' 59' ' ' GLU . 0.1 OUTLIER -29.74 -26.43 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.419 2 N-CA-C 124.78 5.104 . . . . 0.0 124.78 -161.717 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.13 31.54 0.4 Allowed Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 121.901 2.137 . . . . 0.0 110.878 170.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -117.36 -51.33 2.52 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 123.21 1.481 . . . . 0.0 110.448 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.415 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . 58.0 m -86.44 35.71 0.67 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -162.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -66.28 -10.21 40.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.21 -1.556 . . . . 0.0 112.783 150.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -87.22 -35.03 18.77 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.699 2.799 . . . . 0.0 112.601 171.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -94.02 -53.92 3.79 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.366 -1.458 . . . . 0.0 114.905 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.51 -52.21 6.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.135 2.174 . . . . 0.0 113.779 -174.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -41.41 -48.71 3.82 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.76 2.874 . . . . 0.0 118.76 170.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.07 -37.52 15.06 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.689 2.796 . . . . 0.0 112.484 -170.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -77.19 -28.27 53.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.601 -1.312 . . . . 0.0 112.139 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -62.58 -50.08 72.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.243 1.017 . . . . 0.0 113.654 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 18.8 tt -52.75 -42.48 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.38 -17.27 61.3 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.022 -1.674 . . . . 0.0 115.167 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.19 -53.94 6.79 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.455 -1.403 . . . . 0.0 110.265 167.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.3 t -68.61 -25.79 31.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.105 2.162 . . . . 0.0 112.069 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.55 -34.84 78.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.516 -1.99 . . . . 0.0 113.077 172.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -75.28 -29.7 60.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.387 1.475 . . . . 0.0 111.959 177.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.59 -51.86 25.48 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 126.583 1.953 . . . . 0.0 110.09 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.9 mt -62.16 -33.67 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 O-C-N 120.014 -1.678 . . . . 0.0 112.973 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.73 -22.29 61.85 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 169.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -87.12 -46.72 9.51 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.697 -1.877 . . . . 0.0 109.339 165.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -98.1 -15.98 19.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 -150.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.0 t -49.3 -54.89 14.75 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.627 1.558 . . . . 0.0 114.865 173.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.261 1.679 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 168.253 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.491 -1.32 0 CA-C-O 122.888 1.328 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.0 p -64.87 -41.17 95.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 128.86 2.864 . . . . 0.0 114.612 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -70.19 -37.25 75.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.881 -1.762 . . . . 0.0 112.498 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.78 -43.97 87.21 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.802 1.241 . . . . 0.0 110.939 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.436 ' CE2' ' HB1' ' A' ' 34' ' ' ALA . 0.7 OUTLIER -47.96 -46.06 31.92 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.911 1.684 . . . . 0.0 111.665 173.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -77.1 -36.23 55.77 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.883 -1.135 . . . . 0.0 112.833 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -60.57 -51.91 67.42 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.734 1.214 . . . . 0.0 112.376 174.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -84.83 -23.52 29.03 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.454 ' HB3' ' CD1' ' A' ' 31' ' ' TYR . . . -67.24 -46.96 72.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.235 -2.166 . . . . 0.0 113.47 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -68.36 -15.79 63.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 113.661 -1.609 . . . . 0.0 113.47 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.88 -63.93 1.03 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 121.093 -1.005 . . . . 0.0 109.58 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.8 m -63.09 -31.52 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.323 -1.486 . . . . 0.0 114.161 -166.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.59 -14.21 61.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.964 -1.085 . . . . 0.0 113.79 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -137.46 27.14 2.82 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.547 1.139 . . . . 0.0 112.47 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.1 mt -72.21 164.38 59.74 Favored Pre-proline 0 N--CA 1.43 -1.433 0 O-C-N 120.072 -1.642 . . . . 0.0 110.734 175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.62 -29.92 15.47 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.035 2.477 . . . . 0.0 111.184 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 87.6 m -102.4 77.96 1.69 Allowed 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -58.78 152.15 49.51 Favored Pre-proline 0 N--CA 1.431 -1.387 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -67.46 137.83 44.2 Favored 'Trans proline' 0 C--N 1.3 -1.977 0 C-N-CA 122.743 2.295 . . . . 0.0 113.015 -162.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.8 t -70.4 160.57 32.09 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 119.806 1.185 . . . . 0.0 113.126 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.4 m -54.26 -53.78 49.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -158.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -79.29 -16.59 56.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.793 -1.192 . . . . 0.0 113.023 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -83.82 -45.24 13.5 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.669 1.588 . . . . 0.0 109.605 -178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -48.13 -34.02 9.2 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.934 2.894 . . . . 0.0 115.567 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -39.67 65.55 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.204 -1.56 . . . . 0.0 113.81 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -72.65 -38.49 67.65 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.496 -1.378 . . . . 0.0 109.512 177.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -58.1 -46.74 85.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.893 1.677 . . . . 0.0 112.462 171.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -50.93 -57.97 7.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.205 2.202 . . . . 0.0 112.662 169.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.04 -48.98 43.39 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -178.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 69' ' ' ALA . 3.6 mm? -76.17 -38.97 55.98 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.454 ' CD1' ' HB3' ' A' ' 9' ' ' ALA . 12.8 t80 -56.56 -61.77 2.18 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.733 1.213 . . . . 0.0 112.116 173.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.452 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 22.3 mmmt -55.18 -37.08 66.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.983 1.713 . . . . 0.0 112.307 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -54.02 -60.55 3.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.436 ' HB1' ' CE2' ' A' ' 5' ' ' PHE . . . -83.03 -8.57 59.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.844 -1.785 . . . . 0.0 112.743 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 45.6 m -64.31 -67.68 0.41 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.95 -1.094 . . . . 0.0 111.251 166.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.7 m -87.54 -54.28 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.457 -1.402 . . . . 0.0 113.484 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.72 -28.88 5.57 Favored Glycine 0 N--CA 1.431 -1.688 0 C-N-CA 125.489 1.519 . . . . 0.0 113.402 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -119.49 171.72 8.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.565 1.146 . . . . 0.0 109.095 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -72.98 70.15 1.01 Allowed 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 123.443 1.592 . . . . 0.0 112.078 161.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.19 -41.98 27.1 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.229 -1.545 . . . . 0.0 114.472 -160.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.7 mmpt? -85.47 81.6 8.64 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.712 -1.867 . . . . 0.0 112.778 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -84.29 48.1 1.44 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.023 1.392 . . . . 0.0 113.468 -170.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -153.86 89.89 3.38 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 125.212 1.405 . . . . 0.0 108.201 170.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.5 179.38 6.15 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 122.66 2.24 . . . . 0.0 110.611 169.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.46 -175.15 3.18 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 121.151 3.22 . . . . 0.0 121.151 -161.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 pt -87.34 -50.13 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.28 -1.718 . . . . 0.0 112.378 -170.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -91.07 29.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.614 1.965 . . . . 0.0 111.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.325 0.1 OUTLIER -61.33 115.08 3.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.861 2.911 . . . . 0.0 118.861 -156.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.5 tpp -126.18 -64.75 1.02 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.97 -42.62 90.34 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.252 1.421 . . . . 0.0 114.285 177.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.77 -27.1 68.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.3 mtm-85 -67.56 -46.35 72.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.335 -1.478 . . . . 0.0 112.008 174.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -57.38 -48.72 78.31 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.298 1.039 . . . . 0.0 113.064 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -54.32 -54.7 36.72 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 125.546 1.538 . . . . 0.0 114.406 172.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -29.35 65.38 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.536 -1.353 . . . . 0.0 113.355 -176.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -69.78 -39.15 76.79 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 126.523 1.929 . . . . 0.0 112.219 174.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.24 -26.17 64.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.788 -1.195 . . . . 0.0 112.158 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.452 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 7.9 t90 -78.86 -45.22 21.19 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.741 2.016 . . . . 0.0 111.53 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -58.94 -20.96 56.93 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.856 2.862 . . . . 0.0 113.812 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -61.16 -30.14 70.21 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.718 -1.864 . . . . 0.0 113.424 168.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 48.4 mt -112.8 9.46 19.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.812 1.245 . . . . 0.0 112.71 -172.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -26.44 -34.0 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.417 2 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -165.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -158.94 32.97 0.47 Allowed Glycine 0 N--CA 1.43 -1.717 0 O-C-N 119.03 -2.294 . . . . 0.0 113.528 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -116.06 -43.49 2.97 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 119.06 1.43 . . . . 0.0 110.256 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -87.56 46.14 1.35 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.45 -1.406 . . . . 0.0 113.779 -161.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -74.59 -38.07 62.73 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.832 -2.418 . . . . 0.0 108.002 158.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.61 -44.99 61.23 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 129.965 3.306 . . . . 0.0 110.282 -177.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -75.02 -47.47 28.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.731 174.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' ' 30' ' ' LEU . . . -43.19 -59.59 2.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -47.56 -29.33 2.77 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 120.344 3.461 . . . . 0.0 120.344 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -88.86 -34.41 17.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.432 2.293 . . . . 0.0 114.699 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -73.42 -31.14 63.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.457 -1.402 . . . . 0.0 110.905 174.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -67.77 -50.59 56.3 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.654 1.181 . . . . 0.0 112.2 -166.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.98 -47.98 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 167.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.16 48.79 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.08 -43.38 78.69 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.695 -1.253 . . . . 0.0 113.63 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 18.1 t -65.73 -25.46 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.513 1.125 . . . . 0.0 111.3 176.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.41 -41.98 99.1 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.032 -2.292 . . . . 0.0 113.767 171.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.01 -30.88 71.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.075 0.95 . . . . 0.0 113.051 175.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.3 mt -71.41 -57.19 4.67 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.614 1.565 . . . . 0.0 109.816 175.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 2.6 mm -57.23 -39.46 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 126.402 1.881 . . . . 0.0 113.555 -178.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.22 -35.81 62.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 173.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -87.36 -37.96 16.63 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.014 -1.054 . . . . 0.0 111.4 173.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -101.19 -16.58 16.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.026 1.491 . . . . 0.0 115.026 -157.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 p -47.36 -54.93 9.89 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.26 1.646 0 O-C-N 120.396 -1.44 . . . . 0.0 109.065 172.153 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 122.974 1.368 . . . . 0.0 114.233 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 p -57.85 -35.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.531 2.732 . . . . 0.0 112.991 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -64.71 -39.15 93.16 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.679 -1.263 . . . . 0.0 114.368 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 tp -60.47 -46.5 89.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 124.907 2.289 . . . . 0.0 111.744 176.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -54.26 -42.74 70.28 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 128.739 2.816 . . . . 0.0 109.019 177.291 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -72.85 -39.71 66.28 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.095 0.958 . . . . 0.0 113.258 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.33 -43.36 96.49 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.944 1.354 . . . . 0.0 111.451 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.7 mppt? -90.39 -24.11 20.88 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 114.188 -1.369 . . . . 0.0 114.058 -174.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.498 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -67.6 -45.18 76.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.866 -2.396 . . . . 0.0 113.532 176.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.18 -19.2 43.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.698 1.999 . . . . 0.0 113.836 170.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.06 -58.95 2.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 121.26 -0.9 . . . . 0.0 110.39 170.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.9 m -61.39 -26.14 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.241 -1.537 . . . . 0.0 113.586 -170.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -73.79 -12.66 60.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -144.89 29.6 1.21 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.52 -1.363 . . . . 0.0 112.205 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.4 mt -71.99 156.17 91.14 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.747 -1.846 . . . . 0.0 110.11 175.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -72.47 -24.3 19.27 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.692 2.261 . . . . 0.0 110.605 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -101.97 82.07 2.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 104.304 -2.48 . . . . 0.0 104.304 168.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -56.88 148.59 48.04 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 126.766 2.026 . . . . 0.0 114.139 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -64.08 158.38 48.2 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 C-N-CA 123.699 2.932 . . . . 0.0 115.196 -163.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.7 m -74.71 160.56 30.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.77 1.168 . . . . 0.0 113.628 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -64.6 -60.2 3.41 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.72 2.118 . . . . 0.0 116.72 -157.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.31 -23.25 51.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.447 -2.033 . . . . 0.0 112.154 176.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.17 -35.68 66.46 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.767 2.027 . . . . 0.0 112.286 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.2 tp -51.26 -39.27 56.35 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 126.82 2.048 . . . . 0.0 115.348 169.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.98 -32.14 51.14 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.537 -1.977 . . . . 0.0 114.311 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -71.52 -31.4 67.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.878 -1.764 . . . . 0.0 112.992 167.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -67.18 -42.49 84.15 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 127.343 2.257 . . . . 0.0 111.592 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -47.16 -55.01 9.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.481 2.712 . . . . 0.0 112.276 168.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.11 -47.5 65.27 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.512 1.125 . . . . 0.0 113.958 -178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.67 -45.63 78.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 175.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.498 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 18.7 t80 -58.01 -54.74 43.58 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.49 1.516 . . . . 0.0 110.856 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -56.49 -38.69 72.09 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.053 -1.655 . . . . 0.0 113.408 171.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -53.79 -60.97 2.63 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -90.72 -8.32 50.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -178.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 m -64.62 -60.51 3.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 120.419 1.463 . . . . 0.0 113.04 167.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.2 m -88.11 -35.48 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.669 -1.27 . . . . 0.0 114.414 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.01 -23.8 34.11 Favored Glycine 0 N--CA 1.43 -1.744 0 O-C-N 120.333 -1.479 . . . . 0.0 114.728 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -123.97 163.46 21.32 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 118.883 1.342 . . . . 0.0 107.405 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -59.18 84.27 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 155.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.04 -64.67 1.13 Allowed 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.674 -1.891 . . . . 0.0 115.379 -165.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.25 81.61 8.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.227 -1.545 . . . . 0.0 112.867 -174.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -85.11 53.14 2.64 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 124.483 2.087 . . . . 0.0 112.178 -176.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -153.97 87.26 3.68 Favored Pre-proline 0 N--CA 1.43 -1.469 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 167.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -76.43 166.19 27.88 Favored 'Trans proline' 0 C--N 1.299 -2.046 0 C-N-CA 122.06 1.84 . . . . 0.0 108.094 151.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.16 -167.38 27.79 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-N 120.609 1.55 . . . . 0.0 115.868 -167.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -106.95 -42.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 121.486 -1.008 . . . . 0.0 111.436 -162.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -95.71 9.65 39.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.442 1.897 . . . . 0.0 109.679 167.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -82.07 76.36 8.96 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.998 1.319 . . . . 0.0 112.549 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 ptm -70.44 -12.04 61.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -89.12 -56.52 3.25 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.524 -1.36 . . . . 0.0 110.263 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.47 -30.73 67.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.91 1.684 . . . . 0.0 114.037 -175.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -56.1 -45.89 79.29 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.834 -1.792 . . . . 0.0 115.56 173.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -77.36 -42.3 37.07 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.238 1.015 . . . . 0.0 111.468 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -72.52 -34.34 67.52 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.05 1.34 . . . . 0.0 114.362 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -67.23 -30.31 70.18 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.474 -2.016 . . . . 0.0 111.232 168.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.9 -23.65 58.4 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.485 -2.009 . . . . 0.0 112.378 175.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.61 -22.24 64.45 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.386 -2.071 . . . . 0.0 112.762 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -84.19 -54.61 4.69 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.508 1.523 . . . . 0.0 109.509 173.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.16 65.93 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 128.132 2.573 . . . . 0.0 114.967 -175.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -61.23 -30.48 70.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.287 -1.508 . . . . 0.0 112.551 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.4 mp -103.74 29.64 5.64 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.249 1.02 . . . . 0.0 112.814 174.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.61 -46.68 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 175.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -142.36 -6.47 0.74 Allowed Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -169.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -98.42 4.72 48.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.393 2.044 . . . . 0.0 110.416 171.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.0 p -35.04 -51.12 0.52 Allowed 'General case' 0 N--CA 1.43 -1.459 1 C-N-CA 131.786 4.035 . . . . 0.0 117.314 177.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -80.77 -10.5 59.72 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.135 1.374 . . . . 0.0 113.413 -172.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -87.08 -44.4 11.57 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 123.902 0.881 . . . . 0.0 109.808 168.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -90.58 -38.08 13.39 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 119.673 -1.892 . . . . 0.0 113.441 -170.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.81 -61.94 1.98 Allowed 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 119.109 0.868 . . . . 0.0 112.866 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -41.89 -44.22 3.31 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -88.06 -32.19 18.89 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.968 1.707 . . . . 0.0 113.497 -171.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -78.28 -34.4 48.91 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.555 -1.34 . . . . 0.0 110.883 171.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -59.66 -52.27 66.22 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -173.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.87 -53.19 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 171.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.43 -40.19 64.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.5 pp -70.41 -44.34 68.15 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 0.0 113.988 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.6 t -62.94 -31.35 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.951 1.3 . . . . 0.0 111.757 175.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -59.54 -40.76 88.27 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.706 -1.871 . . . . 0.0 113.778 174.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -77.37 -22.77 51.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.661 1.584 . . . . 0.0 113.075 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.11 -59.99 3.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.327 1.451 . . . . 0.0 108.892 165.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.8 mt -65.23 -31.77 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.145 -1.597 . . . . 0.0 114.127 -173.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.86 -36.79 49.62 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.031 -1.668 . . . . 0.0 114.522 169.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -87.47 -41.24 13.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.838 -1.164 . . . . 0.0 110.53 174.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -96.61 -13.01 23.18 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -158.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.3 p -52.04 -58.14 7.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 172.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.261 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.539 171.316 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 122.607 1.194 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -79.31 -24.64 42.7 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.638 1.975 . . . . 0.0 113.384 -170.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -75.83 -39.07 57.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.437 -2.04 . . . . 0.0 112.694 171.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.7 tp -64.38 -37.86 89.02 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 123.037 1.399 . . . . 0.0 111.569 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' A' ' 34' ' ' ALA . 2.1 t80 -46.63 -44.44 18.32 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.137 1.775 . . . . 0.0 112.028 170.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.62 -38.23 40.35 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 121.148 -0.97 . . . . 0.0 111.855 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -56.27 -50.21 72.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.95 1.3 . . . . 0.0 113.155 174.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -78.42 -32.85 48.81 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.303 -1.498 . . . . 0.0 113.499 178.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.63 -45.71 82.0 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.969 -2.332 . . . . 0.0 114.723 -176.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -66.78 -16.87 64.56 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 175.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.16 -59.35 2.82 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.613 -1.304 . . . . 0.0 110.027 164.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.6 m -64.4 -32.46 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 O-C-N 120.552 -1.342 . . . . 0.0 113.68 -167.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -72.55 -10.93 60.39 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -140.62 21.31 2.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.549 1.14 . . . . 0.0 112.505 -177.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.421 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.9 tp -73.96 160.22 82.31 Favored Pre-proline 0 N--CA 1.429 -1.489 0 O-C-N 118.895 -2.378 . . . . 0.0 109.913 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.421 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 94.4 Cg_endo -74.84 -21.59 16.07 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 CA-C-N 124.955 2.805 . . . . 0.0 112.309 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 m -107.87 82.4 1.64 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 102.055 -3.313 . . . . 0.0 102.055 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -63.55 155.31 76.36 Favored Pre-proline 0 N--CA 1.43 -1.458 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.817 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -67.22 150.15 81.66 Favored 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.48 2.12 . . . . 0.0 113.354 -165.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.2 p -80.64 153.94 27.66 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.957 0.884 . . . . 0.0 112.504 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.6 p -75.77 -32.79 60.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 -156.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.86 -31.51 31.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.32 -1.488 . . . . 0.0 109.818 176.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.49 -37.16 82.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.11 1.364 . . . . 0.0 110.373 173.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 mt -54.32 -17.96 3.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.66 -40.13 69.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.058 -2.276 . . . . 0.0 112.923 169.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -66.79 -53.25 34.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.928 0.891 . . . . 0.0 111.248 169.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.46 -36.72 81.72 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 119.863 -1.773 . . . . 0.0 115.717 -175.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -62.42 -53.43 55.01 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 120.851 1.659 . . . . 0.0 111.26 173.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.17 -42.46 66.21 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 119.587 1.085 . . . . 0.0 113.34 -178.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.452 HD12 ' HA ' ' A' ' 69' ' ' ALA . 4.5 mm? -71.98 -51.08 23.66 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -56.49 -50.77 70.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.048 -1.657 . . . . 0.0 112.526 176.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.498 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 28.1 mmmt -62.94 -33.12 74.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.985 -1.697 . . . . 0.0 113.392 174.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -56.99 -61.43 2.45 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 115.41 1.634 . . . . 0.0 115.41 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.592 ' HA ' HE21 ' A' ' 66' ' ' GLN 0.275 . . -79.83 -11.88 59.8 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.676 2.102 . . . . 0.0 116.676 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.1 p -72.34 -50.4 27.04 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 121.577 1.99 . . . . 0.0 111.601 164.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.1 t -87.01 -65.15 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.449 -1.407 . . . . 0.0 111.384 -174.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.74 -12.93 46.4 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 128.24 2.829 . . . . 0.0 113.199 -174.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -125.78 153.79 43.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.153 1.781 . . . . 0.0 106.792 170.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.74 100.74 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.317 -2.114 . . . . 0.0 113.891 158.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.4 -73.63 0.27 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.743 1.617 . . . . 0.0 115.238 -162.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.67 81.33 8.48 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.952 1.301 . . . . 0.0 113.826 -172.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -77.03 43.52 0.36 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.548 2.339 . . . . 0.0 114.071 -173.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.0 ttpt -160.11 82.19 2.27 Favored Pre-proline 0 N--CA 1.43 -1.426 0 O-C-N 120.24 -1.537 . . . . 0.0 109.171 171.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.69 162.03 43.37 Favored 'Trans proline' 0 C--N 1.3 -2.021 0 C-N-CA 122.406 2.071 . . . . 0.0 109.845 170.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.0 -168.49 29.5 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 119.675 2.63 . . . . 0.0 119.675 -160.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.0 pt -110.69 -41.59 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.38 1.872 . . . . 0.0 108.868 -169.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -97.67 4.28 50.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.481 1.513 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.37 113.21 22.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 121.216 -0.927 . . . . 0.0 110.771 170.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -92.2 -30.82 15.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.897 -1.127 . . . . 0.0 109.678 173.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -85.03 -44.19 13.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 123.726 0.81 . . . . 0.0 112.819 -170.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.97 -32.15 67.57 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.326 1.45 . . . . 0.0 113.801 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -52.25 -38.88 59.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -75.28 -47.71 26.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.609 -1.307 . . . . 0.0 112.057 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -53.88 -51.63 63.07 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.284 2.234 . . . . 0.0 112.885 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -28.88 64.22 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.947 -1.096 . . . . 0.0 112.923 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.94 -39.67 79.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.216 -1.552 . . . . 0.0 111.939 175.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.2 -36.27 83.51 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.021 1.329 . . . . 0.0 112.066 174.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.498 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.3 t90 -72.46 -39.92 67.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.172 1.389 . . . . 0.0 113.547 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.72 -21.79 66.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.883 2.073 . . . . 0.0 114.182 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -64.52 -37.29 87.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.494 -2.004 . . . . 0.0 112.961 166.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.02 5.22 52.39 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.47 -1.394 . . . . 0.0 113.524 -175.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -26.61 -39.77 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.437 1 C-N-CA 131.762 4.025 . . . . 0.0 121.671 -160.807 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.92 30.32 0.33 Allowed Glycine 0 N--CA 1.43 -1.701 0 CA-C-N 120.187 1.358 . . . . 0.0 111.604 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -117.48 -61.98 1.63 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.291 -1.123 . . . . 0.0 110.34 173.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -73.15 34.82 0.08 Allowed 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.592 HE21 ' HA ' ' A' ' 34' ' ' ALA 0.252 5.8 tm0? -68.9 -39.98 79.42 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 130.618 3.567 . . . . 0.0 109.674 152.057 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.06 -35.37 74.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.248 3.019 . . . . 0.0 109.847 -177.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -77.65 -48.04 17.79 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.337 1.455 . . . . 0.0 111.976 166.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.452 ' HA ' HD12 ' A' ' 30' ' ' LEU . . . -42.65 -61.72 1.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -175.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -52.99 -23.51 7.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.057 3.355 . . . . 0.0 120.057 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -89.18 -40.91 12.56 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 118.692 -2.505 . . . . 0.0 115.042 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -70.06 -31.59 69.27 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 120.608 -1.308 . . . . 0.0 110.837 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -69.52 -47.34 64.09 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 tt -42.25 -50.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 124.513 1.125 . . . . 0.0 113.945 169.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.52 -43.39 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.6 mt -59.12 -45.0 92.02 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.762 -1.211 . . . . 0.0 113.156 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.4 t -81.99 -25.27 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.429 1.491 . . . . 0.0 111.377 -172.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.01 -29.75 69.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.186 -2.197 . . . . 0.0 113.116 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.17 -32.34 70.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.864 -1.147 . . . . 0.0 113.742 170.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.9 mt -71.28 -56.61 5.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.745 1.618 . . . . 0.0 110.056 173.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 50.3 mt -60.46 -34.77 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.343 1.457 . . . . 0.0 112.705 -174.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.42 -34.47 61.41 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 172.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -87.46 -37.03 17.33 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.258 1.023 . . . . 0.0 111.184 174.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -109.3 -14.53 14.44 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.564 1.691 . . . . 0.0 115.564 -153.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.6 t -43.52 -54.75 4.66 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.324 1.85 . . . . 0.0 115.807 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.26 1.626 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 165.099 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 CA--C 1.49 -1.343 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -56.13 -27.36 53.69 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 118.369 -2.707 . . . . 0.0 114.713 171.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -64.59 -56.72 12.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 168.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.1 tp -53.35 -48.9 68.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.953 2.101 . . . . 0.0 110.987 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 34' ' ' ALA . 46.6 t80 -44.48 -47.8 10.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.017 2.527 . . . . 0.0 112.396 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -80.21 -29.91 38.61 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.166 -0.959 . . . . 0.0 113.535 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -66.05 -48.74 70.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.88 1.324 . . . . 0.0 112.035 173.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.9 mptt -78.32 -30.03 48.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.285 1.434 . . . . 0.0 113.17 -173.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.439 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -65.97 -45.13 82.82 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-O 123.74 1.733 . . . . 0.0 114.129 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.4 mmtm -65.02 -20.84 66.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.753 1.621 . . . . 0.0 113.563 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.21 -56.84 4.43 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.001 -1.062 . . . . 0.0 110.268 168.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 23.7 m -64.46 -26.69 40.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.476 -1.39 . . . . 0.0 114.255 -170.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -70.42 -29.55 66.18 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.024 -1.047 . . . . 0.0 113.413 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -122.04 27.24 8.14 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.557 1.543 . . . . 0.0 112.029 -171.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.5 mt -72.63 164.98 55.94 Favored Pre-proline 0 N--CA 1.429 -1.496 0 O-C-N 119.652 -1.905 . . . . 0.0 111.492 170.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.95 -28.31 6.21 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.804 2.336 . . . . 0.0 111.193 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 m -97.86 84.24 3.3 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 102.335 -3.209 . . . . 0.0 102.335 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -63.4 161.69 31.77 Favored Pre-proline 0 N--CA 1.43 -1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 113.61 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.417 ' HA ' ' CE2' ' A' ' 84' ' ' TYR . 93.5 Cg_exo -65.96 142.97 70.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 121.99 1.746 . . . . 0.0 115.532 -164.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.9 m -70.23 148.59 48.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.772 1.229 . . . . 0.0 111.508 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.0 p -69.12 -34.67 75.4 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -159.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -83.66 -22.79 32.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.418 -1.426 . . . . 0.0 112.632 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.58 -45.12 39.53 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.499 1.119 . . . . 0.0 110.606 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.1 tp -45.98 -35.44 4.73 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.434 2.294 . . . . 0.0 116.366 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.7 mt -55.19 -54.37 44.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.431 1.492 . . . . 0.0 114.97 170.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.63 -40.46 76.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.393 1.077 . . . . 0.0 112.759 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.33 -33.89 73.8 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.745 -1.222 . . . . 0.0 113.014 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.407 ' CD1' ' HB3' ' A' ' 54' ' ' LYS . 15.8 t80 -57.59 -55.42 35.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.701 1.6 . . . . 0.0 110.548 164.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.85 -54.17 32.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.543 1.137 . . . . 0.0 112.363 -174.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.95 -44.9 94.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.439 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.4 t80 -57.14 -52.82 63.78 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.181 1.467 . . . . 0.0 111.445 177.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.519 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.8 mmmt -61.15 -36.9 81.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.494 -2.004 . . . . 0.0 112.912 174.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -56.86 -57.17 13.64 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.998 1.319 . . . . 0.0 114.34 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 5' ' ' PHE . . . -94.13 -0.09 55.5 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.17 -0.956 . . . . 0.0 113.063 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 m -68.51 -60.63 2.29 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.783 -1.198 . . . . 0.0 110.381 162.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 4.8 m -87.64 -45.56 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.228 -1.545 . . . . 0.0 114.69 -176.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.23 11.61 41.7 Favored Glycine 0 N--CA 1.43 -1.729 0 C-N-CA 126.153 1.835 . . . . 0.0 115.321 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -146.29 178.77 7.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -75.94 119.92 20.56 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.375 -1.453 . . . . 0.0 111.292 145.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -101.02 -80.0 0.5 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.454 -1.404 . . . . 0.0 112.851 -168.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.28 81.77 1.36 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.114 1.766 . . . . 0.0 115.077 -168.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -79.77 61.46 3.72 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.319 1.447 . . . . 0.0 111.458 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -160.37 76.36 2.73 Favored Pre-proline 0 N--CA 1.43 -1.437 0 C-N-CA 125.455 1.502 . . . . 0.0 109.986 162.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -75.9 167.53 26.0 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 CA-C-N 124.098 2.499 . . . . 0.0 109.953 166.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.32 -172.86 32.03 Favored Glycine 0 N--CA 1.43 -1.737 0 CA-C-N 121.182 1.81 . . . . 0.0 115.852 -168.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.6 pt -102.32 -49.09 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 124.739 1.216 . . . . 0.0 109.568 -166.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.16 32.95 4.56 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.477 1.911 . . . . 0.0 107.71 167.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -95.41 94.29 7.73 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 120.617 -1.302 . . . . 0.0 108.364 169.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -69.61 -43.38 72.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 111.279 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -59.46 -56.09 26.43 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.724 2.01 . . . . 0.0 112.802 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.415 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 21.8 m-20 -66.15 -31.06 71.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -61.07 -41.85 97.4 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.118 -1.614 . . . . 0.0 115.121 170.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -66.63 -47.75 71.62 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.104 -0.998 . . . . 0.0 113.185 173.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' A' ' 51' ' ' ASP . 91.3 mttt -56.98 -46.49 82.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.306 1.443 . . . . 0.0 113.649 177.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.06 -31.53 67.97 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.715 -1.241 . . . . 0.0 113.119 -176.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -69.09 -37.05 78.24 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.965 -1.71 . . . . 0.0 112.182 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.42 67.62 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.443 -1.41 . . . . 0.0 112.657 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.519 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.7 t90 -80.81 -49.16 11.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.59 1.956 . . . . 0.0 111.456 177.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -55.27 -30.62 60.46 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.804 2.842 . . . . 0.0 112.781 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -49.9 -38.15 34.56 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.159 -1.588 . . . . 0.0 115.206 167.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.9 mp -116.78 38.85 3.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 122.343 1.068 . . . . 0.0 111.263 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -39.21 -41.78 0.9 Allowed 'General case' 0 N--CA 1.429 -1.491 1 N-CA-C 122.339 4.199 . . . . 0.0 122.339 174.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -109.43 -44.64 1.05 Allowed Glycine 0 N--CA 1.431 -1.653 0 CA-C-N 120.516 1.507 . . . . 0.0 113.476 -173.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptmm? -94.1 17.4 12.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 124.689 2.185 . . . . 0.0 112.135 -167.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -45.72 -50.59 13.6 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 131.527 3.931 . . . . 0.0 117.488 -170.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -67.28 -34.52 77.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 122.331 1.063 . . . . 0.0 113.186 -168.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -77.93 -45.04 25.13 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.709 2.003 . . . . 0.0 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -93.1 -14.45 27.24 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.621 -1.299 . . . . 0.0 111.603 -167.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.87 -62.35 1.55 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.223 -1.548 . . . . 0.0 113.451 162.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -44.57 -44.1 8.54 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 118.857 2.91 . . . . 0.0 118.857 -173.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 -21.34 24.67 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.319 -1.488 . . . . 0.0 113.879 -171.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -89.99 -25.76 20.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.98 -1.075 . . . . 0.0 111.193 172.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.91 -48.43 71.45 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 tt -39.16 -52.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 171.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.67 -20.62 56.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.16 -56.02 6.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.33 -1.481 . . . . 0.0 110.056 167.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.0 t -68.65 -27.27 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 124.876 1.271 . . . . 0.0 111.403 -167.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -63.52 -40.43 97.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.029 -1.669 . . . . 0.0 113.813 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -74.05 -26.57 60.47 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.999 -1.063 . . . . 0.0 113.161 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.4 mp -66.08 -61.38 2.07 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.592 1.157 . . . . 0.0 108.587 168.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.9 mm -54.31 -40.41 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 126.211 1.804 . . . . 0.0 113.997 -176.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.36 -38.55 59.04 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -87.53 -39.55 15.04 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.392 -1.443 . . . . 0.0 112.966 172.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.417 ' CE2' ' HA ' ' A' ' 19' ' ' PRO . 3.0 m-30 -86.18 -17.54 34.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.504 -1.373 . . . . 0.0 112.63 -162.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.2 m -47.05 -57.42 5.06 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 170.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 C--O 1.261 1.69 0 O-C-N 121.053 -1.029 . . . . 0.0 108.906 174.93 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.49 HG11 ' H ' ' A' ' 4' ' ' LEU . 2.3 t . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 m -70.64 -19.66 62.8 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.724 2.81 . . . . 0.0 113.66 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -68.84 -43.31 75.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.185 -2.197 . . . . 0.0 112.911 171.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.49 ' H ' HG11 ' A' ' 1' ' ' VAL . 53.4 tp -59.7 -48.79 80.28 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.312 1.445 . . . . 0.0 109.973 174.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.418 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 30.6 t80 -44.47 -49.54 9.81 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.266 1.827 . . . . 0.0 112.615 176.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -74.95 -38.44 61.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.988 -1.07 . . . . 0.0 112.635 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.23 -50.28 74.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.7 1.2 . . . . 0.0 112.511 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.59 -25.37 26.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.623 1.169 . . . . 0.0 112.747 -174.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.468 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.31 -46.51 73.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.603 -1.936 . . . . 0.0 113.44 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -62.49 -20.02 64.17 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.649 1.179 . . . . 0.0 113.888 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.07 -57.24 3.95 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.594 1.158 . . . . 0.0 111.366 169.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -63.71 -28.41 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.555 -1.341 . . . . 0.0 113.789 -171.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -72.65 -14.21 61.54 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -133.7 11.22 4.03 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.428 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.6 tp -66.5 150.78 97.0 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 126.625 1.97 . . . . 0.0 111.656 -176.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.428 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 56.1 Cg_endo -75.81 -14.54 19.41 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.165 2.577 . . . . 0.0 111.803 -172.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.7 m -105.27 77.79 1.33 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 102.264 -3.235 . . . . 0.0 102.264 170.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.66 151.15 72.73 Favored Pre-proline 0 N--CA 1.431 -1.407 0 C-N-CA 125.503 1.521 . . . . 0.0 113.663 -171.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -64.04 149.9 89.5 Favored 'Trans proline' 0 N--CA 1.434 -1.979 0 C-N-CA 122.864 2.376 . . . . 0.0 113.173 -167.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m -71.02 160.69 32.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 120.693 1.588 . . . . 0.0 112.446 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.0 t -57.13 -47.85 80.1 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.928 -1.732 . . . . 0.0 115.354 -171.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -77.29 -26.48 52.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.43 -1.419 . . . . 0.0 112.452 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.67 -53.45 27.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.635 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.3 tp -48.31 -30.48 4.91 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 127.234 2.213 . . . . 0.0 116.599 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.74 -51.34 65.37 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.458 -1.401 . . . . 0.0 114.269 172.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -80.12 -32.88 39.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.904 -1.122 . . . . 0.0 112.499 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.93 -26.25 62.22 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.992 -1.693 . . . . 0.0 111.751 174.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.91 -57.67 11.89 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.237 1.415 . . . . 0.0 109.925 161.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.95 -53.26 27.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.096 1.358 . . . . 0.0 113.79 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 72' ' ' GLU . 1.1 mp -65.2 -41.17 94.77 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 116.444 2.016 . . . . 0.0 116.444 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.468 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.7 t80 -62.24 -50.13 72.98 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.377 1.56 . . . . 0.0 111.332 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.448 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.8 mmmt -61.11 -33.71 73.81 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.834 -1.791 . . . . 0.0 113.077 172.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -59.48 -61.07 2.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.742 -1.224 . . . . 0.0 114.248 176.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.278 . . -86.45 -7.44 58.42 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.4 p -70.82 -55.6 8.17 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.929 2.15 . . . . 0.0 111.636 163.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.1 t -72.96 -58.21 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.512 -1.368 . . . . 0.0 111.469 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.9 -1.4 59.55 Favored Glycine 0 N--CA 1.43 -1.725 0 C-N-CA 126.365 1.936 . . . . 0.0 113.016 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -141.87 168.46 19.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -58.95 137.41 57.9 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.442 -1.411 . . . . 0.0 114.16 150.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -113.35 -86.19 0.58 Allowed 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.799 -1.813 . . . . 0.0 113.009 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -84.62 86.84 7.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.562 -1.336 . . . . 0.0 111.405 -169.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -80.22 53.4 1.75 Allowed 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 123.932 1.825 . . . . 0.0 112.889 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.89 77.42 2.81 Favored Pre-proline 0 N--CA 1.43 -1.448 0 C-N-CA 127.549 2.34 . . . . 0.0 109.28 169.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.63 151.94 58.81 Favored 'Trans proline' 0 C--N 1.299 -2.062 0 O-C-N 117.918 -1.675 . . . . 0.0 108.264 152.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.86 172.15 51.46 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 120.469 1.486 . . . . 0.0 114.533 -170.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.3 pp -92.6 -40.41 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.361 0 O-C-N 120.429 -1.63 . . . . 0.0 110.575 -159.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -86.76 -2.17 58.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.092 1.757 . . . . 0.0 110.275 164.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -83.18 71.46 10.18 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.855 -1.153 . . . . 0.0 111.943 -173.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.6 mmt -54.1 -47.01 72.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.223 1.409 . . . . 0.0 114.156 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -64.67 -42.8 95.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.58 1.152 . . . . 0.0 113.899 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -67.91 -39.86 83.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.772 -1.205 . . . . 0.0 112.901 175.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -57.3 -43.91 83.63 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.353 -1.467 . . . . 0.0 114.68 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -59.52 -49.48 77.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.458 -1.401 . . . . 0.0 114.368 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -72.97 -33.25 65.75 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.047 -1.033 . . . . 0.0 113.378 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -70.69 -37.36 73.59 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.771 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.05 -33.29 73.36 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.51 -1.994 . . . . 0.0 112.207 173.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.81 -23.77 67.34 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.725 -1.234 . . . . 0.0 112.632 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.448 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -83.89 -54.46 4.86 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.613 1.965 . . . . 0.0 111.139 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -54.76 -24.56 22.96 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 130.501 3.52 . . . . 0.0 115.035 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -57.07 -32.08 65.88 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 118.571 -2.58 . . . . 0.0 113.726 166.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.2 mp -116.88 41.01 2.83 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 122.458 1.123 . . . . 0.0 111.399 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -49.92 -26.81 4.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 172.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -116.14 -44.96 0.6 Allowed Glycine 0 N--CA 1.43 -1.702 0 CA-C-N 119.365 0.984 . . . . 0.0 113.443 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -96.0 16.56 17.55 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.089 1.9 . . . . 0.0 112.21 -171.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.04 -50.53 8.34 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 129.8 3.24 . . . . 0.0 116.939 -172.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -76.95 -10.66 59.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -86.42 -50.27 7.02 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 174.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -29.3 16.94 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -166.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.06 -61.46 2.36 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.173 -0.954 . . . . 0.0 113.239 176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -47.16 -32.17 4.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 177.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -85.32 -33.41 22.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.921 -1.737 . . . . 0.0 114.35 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.405 ' HB2' HD22 ' A' ' 30' ' ' LEU . 5.8 mm-40 -84.97 -32.47 22.99 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.416 -1.428 . . . . 0.0 109.901 173.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -63.97 -46.67 83.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.335 -1.478 . . . . 0.0 114.363 -171.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.2 tt -39.02 -56.48 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 167.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -31.42 65.23 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.32 -55.54 17.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.246 1.018 . . . . 0.0 111.579 172.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.4 t -71.67 -24.88 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.133 1.773 . . . . 0.0 111.261 -170.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.23 -34.59 78.72 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.76 -1.838 . . . . 0.0 112.968 171.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -76.87 -26.59 54.41 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.804 -1.185 . . . . 0.0 112.842 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.59 -61.81 1.71 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.826 -1.171 . . . . 0.0 108.558 169.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.56 -41.67 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.607 1.563 . . . . 0.0 113.777 -172.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.53 67.44 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -87.18 -36.0 18.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.575 1.55 . . . . 0.0 110.542 173.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -103.56 -22.0 13.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -157.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -39.42 -54.99 1.84 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.261 1.668 0 C-N-CA 123.848 0.859 . . . . 0.0 110.872 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 121.051 0.453 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -80.75 -2.33 46.53 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.682 -1.886 . . . . 0.0 114.011 -166.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -74.04 -60.69 2.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.451 -1.406 . . . . 0.0 110.698 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.508 HD21 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -62.27 -32.38 73.08 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 126.199 1.8 . . . . 0.0 111.594 178.323 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.449 ' CZ ' ' HB2' ' A' ' 34' ' ' ALA . 78.0 t80 -50.03 -55.07 16.21 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.876 1.67 . . . . 0.0 111.691 175.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.45 -28.9 52.55 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.918 -1.114 . . . . 0.0 111.958 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -45.75 91.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.584 1.154 . . . . 0.0 112.457 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -84.39 -26.86 28.05 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.237 -1.539 . . . . 0.0 112.99 177.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.464 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -49.68 64.75 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.986 1.851 . . . . 0.0 114.32 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.33 -18.55 64.74 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.914 -1.494 . . . . 0.0 113.247 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.61 -62.32 1.49 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 110.16 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 32.4 m -63.61 -31.12 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 120.322 1.419 . . . . 0.0 113.825 -169.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -72.89 -10.21 59.55 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.056 -1.027 . . . . 0.0 113.465 176.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -144.55 36.57 1.19 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.654 1.216 . . . . 0.0 112.457 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -71.7 168.82 19.03 Favored Pre-proline 0 N--CA 1.431 -1.417 0 O-C-N 119.81 -1.806 . . . . 0.0 110.969 170.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -76.23 -27.48 8.05 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 124.563 2.665 . . . . 0.0 110.756 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 90.2 m -106.79 75.52 1.06 Allowed 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -60.49 157.51 35.71 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -68.05 143.74 61.08 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 122.756 2.02 . . . . 0.0 114.668 -159.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -82.24 152.59 26.31 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.448 -0.783 . . . . 0.0 112.696 175.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.9 m -54.06 -54.21 42.45 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -161.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -70.23 -13.23 62.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.334 -1.479 . . . . 0.0 113.893 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -87.04 -55.65 3.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.149 1.379 . . . . 0.0 107.851 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -42.29 -45.21 4.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 128.626 2.77 . . . . 0.0 116.811 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -50.34 -56.63 10.48 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -71.82 -35.5 69.94 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 112.688 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -64.63 -41.29 96.26 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.368 -1.457 . . . . 0.0 113.066 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -53.21 -50.0 65.58 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.48 1.912 . . . . 0.0 111.846 167.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.93 -46.95 75.0 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.4 mp -66.57 -49.82 65.13 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.464 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 18.0 t80 -51.75 -52.52 48.09 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.032 1.733 . . . . 0.0 111.379 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.504 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.0 mmmt -68.74 -25.62 64.83 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.258 -1.526 . . . . 0.0 113.034 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -63.15 -54.29 40.08 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.481 -2.012 . . . . 0.0 116.008 172.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.449 ' HB2' ' CZ ' ' A' ' 5' ' ' PHE 0.266 . . -93.97 -0.08 55.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.003 -1.686 . . . . 0.0 112.693 -178.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -71.94 -59.7 2.61 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.066 -1.646 . . . . 0.0 111.157 157.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.5 t -85.24 -61.94 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.046 -1.659 . . . . 0.0 113.351 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.99 -8.91 50.47 Favored Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 126.781 2.134 . . . . 0.0 114.254 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -130.92 158.66 39.63 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.827 -2.286 . . . . 0.0 104.827 170.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.33 120.44 9.28 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.646 -1.909 . . . . 0.0 113.512 151.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -93.18 -81.27 0.36 Allowed 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.102 -1.624 . . . . 0.0 113.125 -165.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -78.94 86.58 4.81 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.077 1.351 . . . . 0.0 113.176 -169.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.8 48.89 0.85 Allowed 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.476 1.911 . . . . 0.0 112.409 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -160.31 86.8 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.433 0 C-N-CA 128.053 2.541 . . . . 0.0 107.407 168.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.71 159.93 47.48 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.269 1.979 . . . . 0.0 108.776 157.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.23 -160.95 12.7 Favored Glycine 0 N--CA 1.431 -1.696 0 N-CA-C 117.737 1.855 . . . . 0.0 117.737 -165.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 28.8 pt -100.13 -50.39 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.24 -1.153 . . . . 0.0 111.194 -161.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -94.67 -1.58 52.84 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.158 1.783 . . . . 0.0 110.146 169.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -77.54 69.83 3.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.573 1.549 . . . . 0.0 115.075 -169.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.2 mmt -54.62 -46.8 73.95 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 125.81 1.644 . . . . 0.0 114.251 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -61.7 -45.14 95.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -61.23 -41.77 97.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.705 -1.247 . . . . 0.0 114.107 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.8 mtp85 -62.37 -40.24 95.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -62.05 -52.6 63.29 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.0 -1.688 . . . . 0.0 113.79 171.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -69.6 -30.66 68.46 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.334 -1.479 . . . . 0.0 113.78 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -71.01 -33.0 69.93 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.988 -1.695 . . . . 0.0 112.799 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -68.48 -34.95 76.83 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.524 -1.985 . . . . 0.0 112.235 171.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.86 -28.33 68.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.346 -1.471 . . . . 0.0 112.654 175.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.504 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.7 t90 -79.03 -39.09 34.92 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.193 1.797 . . . . 0.0 112.277 175.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -66.29 -14.41 61.96 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.888 1.675 . . . . 0.0 113.636 175.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -74.04 -16.4 61.05 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 117.744 -3.098 . . . . 0.0 113.807 165.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 65' ' ' SER . 61.5 mt -110.95 -14.68 13.91 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.968 -1.708 . . . . 0.0 113.814 -176.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.259 0.3 OUTLIER -27.69 -32.93 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 2 N-CA-C 124.41 4.967 . . . . 0.0 124.41 -154.525 . . . . . . . . 4 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.82 15.03 2.19 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 121.139 1.79 . . . . 0.0 110.839 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -109.85 -61.48 1.64 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 123.333 1.54 . . . . 0.0 108.719 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.4 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . 58.7 m -87.52 43.36 1.1 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.809 -1.087 . . . . 0.0 113.571 -159.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -76.02 -37.32 58.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.9 1.68 . . . . 0.0 107.22 157.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.47 -26.53 65.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 128.758 2.823 . . . . 0.0 111.587 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -86.93 -48.42 8.17 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.904 1.281 . . . . 0.0 111.739 165.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.63 -59.69 1.82 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 179.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.0 -29.35 3.39 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -89.59 -61.16 1.76 Allowed 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.301 -2.124 . . . . 0.0 113.66 172.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -70.06 -18.72 63.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.435 1.094 . . . . 0.0 111.886 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.14 -51.87 66.14 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.111 -0.993 . . . . 0.0 112.562 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 10.5 tt -59.46 -32.75 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 176.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.73 84.11 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.016 -1.678 . . . . 0.0 114.795 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -69.62 -44.24 71.08 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.671 -1.268 . . . . 0.0 112.199 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.2 t -69.37 -25.12 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.804 2.041 . . . . 0.0 110.844 -174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -62.74 -37.4 86.41 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.846 -1.784 . . . . 0.0 112.981 170.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -75.05 -19.05 60.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -75.36 -60.26 2.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.74 1.616 . . . . 0.0 108.823 169.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.0 mm -53.44 -36.74 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 C-N-CA 128.458 2.703 . . . . 0.0 113.661 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.05 34.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 172.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -87.77 -50.99 6.11 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.81 -1.182 . . . . 0.0 112.092 163.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -89.81 -13.99 35.43 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 -150.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.0 t -48.3 -54.83 12.37 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.007 1.723 . . . . 0.0 114.111 176.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 C--O 1.26 1.645 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 172.79 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.4 t -86.68 6.8 29.41 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 129.645 3.178 . . . . 0.0 114.613 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -65.99 -54.44 26.14 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 118.874 -2.391 . . . . 0.0 110.901 174.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.498 HD21 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -63.29 -35.65 81.06 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.571 2.748 . . . . 0.0 111.746 179.02 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.466 ' CZ ' ' HB1' ' A' ' 34' ' ' ALA . 64.4 t80 -52.46 -55.59 20.86 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.05 1.74 . . . . 0.0 110.157 175.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.75 -33.95 62.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.068 -1.02 . . . . 0.0 112.807 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.15 85.34 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.961 1.704 . . . . 0.0 112.401 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -90.91 -33.05 15.77 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.345 -1.472 . . . . 0.0 114.6 170.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.403 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -62.05 -41.92 98.64 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.981 -2.324 . . . . 0.0 114.583 -176.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -67.09 -16.07 64.11 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 124.419 1.088 . . . . 0.0 112.473 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.99 -54.18 6.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.628 -1.295 . . . . 0.0 111.987 163.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . 0.253 1.9 m -65.92 -26.6 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 O-C-N 120.312 -1.492 . . . . 0.0 113.598 -172.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -68.35 -10.74 57.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -155.78 47.74 0.5 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.113 1.435 . . . . 0.0 110.544 171.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.89 154.81 94.51 Favored Pre-proline 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 0.0 110.808 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.64 -19.08 11.6 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 124.584 2.673 . . . . 0.0 111.364 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 m -115.68 77.48 1.09 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 101.075 -3.676 . . . . 0.0 101.075 173.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -53.0 148.85 13.12 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -173.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_exo -58.74 147.26 88.98 Favored 'Trans proline' 0 N--CA 1.433 -2.066 0 C-N-CA 124.074 3.183 . . . . 0.0 113.62 -174.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -73.59 167.69 20.82 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.031 1.287 . . . . 0.0 113.383 -168.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 t -59.75 -42.92 94.3 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -164.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -85.09 -18.42 34.34 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.586 1.154 . . . . 0.0 112.905 173.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -76.67 -48.28 19.47 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 110.966 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.5 tp -45.46 -27.02 0.64 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 129.289 3.036 . . . . 0.0 116.808 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.7 mt -79.44 -49.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.829 2.452 . . . . 0.0 113.37 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.5 -39.7 92.19 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.138 -1.601 . . . . 0.0 112.858 171.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.781 1.633 . . . . 0.0 111.888 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.72 -56.49 21.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.213 1.405 . . . . 0.0 111.518 165.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -44.46 65.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.08 -41.95 60.91 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 175.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.403 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 42.2 t80 -62.16 -50.45 71.79 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.229 -1.544 . . . . 0.0 111.195 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 23.5 mmmt -57.14 -38.81 74.04 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.974 -1.704 . . . . 0.0 113.023 169.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -52.11 -61.65 2.13 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 120.243 1.383 . . . . 0.0 114.655 176.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.466 ' HB1' ' CZ ' ' A' ' 5' ' ' PHE 0.268 . . -87.69 -13.06 43.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 118.764 -1.175 . . . . 0.0 113.627 -176.816 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.5 m -65.0 -59.13 4.49 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.368 1.44 . . . . 0.0 112.574 170.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.3 m -88.12 -31.35 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.372 -1.455 . . . . 0.0 114.3 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.19 -6.52 61.72 Favored Glycine 0 N--CA 1.431 -1.691 0 O-C-N 119.535 -1.978 . . . . 0.0 116.405 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -143.35 172.36 12.87 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -61.41 92.68 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.9 -1.125 . . . . 0.0 113.433 153.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.34 -64.34 1.17 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.823 -1.798 . . . . 0.0 114.626 -163.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -90.03 81.65 6.2 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.006 -1.684 . . . . 0.0 111.99 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -72.38 21.51 0.06 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.071 2.148 . . . . 0.0 116.509 -165.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -149.64 96.22 3.63 Favored Pre-proline 0 N--CA 1.429 -1.492 0 C-N-CA 126.722 2.009 . . . . 0.0 107.096 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -75.68 -179.0 4.71 Favored 'Trans proline' 0 N--CA 1.433 -2.059 0 C-N-CA 122.734 2.29 . . . . 0.0 110.836 163.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.6 179.97 32.72 Favored Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.548 -1.345 . . . . 0.0 113.7 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.0 pt -95.42 -44.38 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 121.084 -1.245 . . . . 0.0 108.207 -165.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -102.37 9.81 39.52 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.731 1.612 . . . . 0.0 109.796 171.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -75.83 87.08 2.82 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 121.129 -0.982 . . . . 0.0 111.107 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.4 tpt -70.95 -26.33 63.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.708 1.603 . . . . 0.0 112.701 -169.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -58.48 3.26 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.281 -1.512 . . . . 0.0 111.83 172.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -63.94 -29.95 71.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -174.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -53.9 -35.49 61.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 170.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -87.49 -46.84 9.24 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.459 -1.401 . . . . 0.0 111.929 173.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -81.41 -16.73 51.27 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.758 -1.839 . . . . 0.0 114.097 -167.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -71.42 -31.56 67.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.932 -1.73 . . . . 0.0 110.78 164.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -70.65 -28.27 64.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.429 -2.044 . . . . 0.0 112.397 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.62 -18.3 64.28 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.316 -1.49 . . . . 0.0 113.604 169.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.437 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -88.38 -52.47 5.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.313 1.845 . . . . 0.0 109.873 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -11.38 37.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.874 -1.766 . . . . 0.0 115.057 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -50.2 -36.52 31.02 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.192 -1.567 . . . . 0.0 113.109 161.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.27 40.85 2.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.462 1.505 . . . . 0.0 112.283 175.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -34.57 -41.3 0.12 Allowed 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 123.611 4.671 . . . . 0.0 123.611 171.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -137.1 -15.01 0.82 Allowed Glycine 0 N--CA 1.429 -1.78 0 CA-C-N 121.438 1.927 . . . . 0.0 113.241 -165.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.419 ' HZ1' ' CG ' ' A' ' 68' ' ' ASP . 43.4 tttm -102.27 17.96 22.13 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 124.599 2.142 . . . . 0.0 109.43 178.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -52.21 -52.05 54.62 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.783 2.833 . . . . 0.0 116.092 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -76.74 -10.45 59.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.199 -1.563 . . . . 0.0 113.92 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -89.93 -40.65 12.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 123.717 0.807 . . . . 0.0 110.228 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.419 ' CG ' ' HZ1' ' A' ' 64' ' ' LYS . 81.4 m-20 -93.18 -45.7 7.75 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.912 -1.117 . . . . 0.0 113.417 -175.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.16 -50.3 69.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -174.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -41.95 -43.14 3.02 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.702 2.482 . . . . 0.0 117.702 171.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -88.83 -44.97 10.11 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.344 1.857 . . . . 0.0 111.55 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.16 -24.51 59.41 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.921 -1.112 . . . . 0.0 112.59 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -67.86 -53.41 26.95 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.002 0.921 . . . . 0.0 112.875 -179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.1 tt -50.4 -36.3 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.97 -37.25 81.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.654 -1.904 . . . . 0.0 114.786 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.2 mt -66.87 -47.99 70.18 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.569 -1.332 . . . . 0.0 111.863 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 50.5 t -73.66 -24.29 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.581 1.552 . . . . 0.0 111.436 -171.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.93 -35.0 76.29 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.309 -2.119 . . . . 0.0 112.757 170.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -69.55 -31.69 70.05 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.309 -1.495 . . . . 0.0 112.394 173.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.08 -63.6 1.03 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.599 1.959 . . . . 0.0 109.247 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mt -68.1 -30.14 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 120.389 -1.444 . . . . 0.0 113.432 -168.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.16 -29.88 58.7 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -87.73 -47.54 8.56 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.659 -1.276 . . . . 0.0 111.847 167.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -98.67 -7.68 27.47 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.361 1.465 . . . . 0.0 114.699 -152.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 46.2 t -46.54 -54.92 8.39 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.967 1.707 . . . . 0.0 114.868 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.26 1.634 0 C-N-CA 124.1 0.96 . . . . 0.0 109.522 167.139 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 CA--C 1.49 -1.333 0 CA-C-O 122.277 1.036 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 m -52.65 -28.39 21.35 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 130.451 3.5 . . . . 0.0 115.328 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -74.99 -48.29 24.89 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.573 -1.329 . . . . 0.0 111.118 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.2 tp -56.93 -46.33 82.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.466 1.506 . . . . 0.0 111.308 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -43.73 -53.1 6.11 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.909 2.084 . . . . 0.0 112.278 -175.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.38 -31.17 20.25 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.286 -0.884 . . . . 0.0 110.965 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -58.96 -42.73 90.61 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.379 1.072 . . . . 0.0 113.008 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -90.89 -21.75 21.25 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 125.126 1.371 . . . . 0.0 113.148 177.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.407 ' HB3' ' CD1' ' A' ' 31' ' ' TYR . . . -65.84 -47.18 75.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.268 -2.145 . . . . 0.0 113.136 171.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -65.28 -18.61 65.45 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.68 -59.17 2.89 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 123.496 0.719 . . . . 0.0 110.355 167.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.9 m -61.83 -30.72 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 O-C-N 120.545 -1.347 . . . . 0.0 113.308 -171.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -69.17 -23.0 63.88 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -130.77 33.66 4.2 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 123.744 0.817 . . . . 0.0 111.933 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.3 mt -74.11 158.37 85.73 Favored Pre-proline 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 0.0 110.238 172.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -75.51 -24.37 12.1 Favored 'Trans proline' 0 C--N 1.299 -2.041 0 C-N-CA 122.752 2.302 . . . . 0.0 110.848 -176.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.1 m -100.71 83.24 2.54 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 169.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -61.09 155.13 57.21 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 126.6 1.96 . . . . 0.0 113.644 -173.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -61.6 142.29 94.12 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.931 2.421 . . . . 0.0 115.084 -168.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m -76.65 159.07 30.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 t -61.98 -37.79 86.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -160.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -90.31 -23.76 21.07 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.669 -1.894 . . . . 0.0 112.854 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -72.16 -50.56 26.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.921 2.089 . . . . 0.0 110.374 -176.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.0 tp -42.06 -38.78 1.75 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.522 2.329 . . . . 0.0 116.465 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -72.72 -45.25 59.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.147 2.179 . . . . 0.0 114.908 -179.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.44 -39.86 94.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.395 1.878 . . . . 0.0 111.514 172.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.62 -28.61 40.94 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.652 1.981 . . . . 0.0 112.671 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -52.2 -55.05 23.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.138 2.175 . . . . 0.0 110.334 167.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.43 -53.12 31.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.638 0.775 . . . . 0.0 112.904 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 -43.63 93.8 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 174.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.407 ' CD1' ' HB3' ' A' ' 9' ' ' ALA . 21.7 t80 -56.85 -57.18 13.59 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.323 -1.486 . . . . 0.0 111.142 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -57.05 -37.01 71.18 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.697 1.999 . . . . 0.0 113.6 174.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -53.3 -59.85 4.04 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.361 0.982 . . . . 0.0 113.314 174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.06 -10.0 55.75 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.117 -0.989 . . . . 0.0 113.33 -176.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 48.0 m -66.21 -59.44 3.75 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.17 -0.956 . . . . 0.0 111.706 170.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.42 -56.72 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.354 -1.466 . . . . 0.0 114.631 174.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.84 -9.81 23.34 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 115.762 1.065 . . . . 0.0 115.762 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -132.64 163.46 28.87 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 172.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -67.78 79.59 0.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.043 -1.661 . . . . 0.0 114.343 162.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -77.57 -54.74 6.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.304 -2.123 . . . . 0.0 115.296 -161.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.8 mmpt? -87.11 81.72 7.93 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.031 -1.668 . . . . 0.0 112.982 -171.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -83.69 51.61 2.06 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.063 1.887 . . . . 0.0 110.657 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.0 tttp -155.65 84.36 3.48 Favored Pre-proline 0 N--CA 1.429 -1.494 0 C-N-CA 127.787 2.435 . . . . 0.0 107.629 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.53 -165.8 0.35 Allowed 'Trans proline' 0 C--N 1.3 -2.002 0 C-N-CA 123.254 2.636 . . . . 0.0 110.63 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.29 -176.61 44.75 Favored Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 121.676 2.034 . . . . 0.0 114.636 -179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -98.93 -52.36 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 121.346 -1.09 . . . . 0.0 108.777 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -94.53 5.27 52.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.464 1.506 . . . . 0.0 110.921 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -64.92 121.36 14.46 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 121.256 -0.903 . . . . 0.0 112.54 -174.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 99.3 mmm -85.11 -36.95 20.8 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.686 -1.259 . . . . 0.0 111.289 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -76.4 -53.38 8.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.368 1.467 . . . . 0.0 112.543 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -56.76 -37.45 71.07 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -171.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -51.63 -43.26 62.52 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.703 1.742 . . . . 0.0 115.703 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.261 51.5 p90 -87.49 -39.08 15.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.333 -1.48 . . . . 0.0 113.682 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . 0.325 0.0 OUTLIER -84.14 -16.35 43.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -178.587 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -70.45 -34.0 71.94 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.667 -1.896 . . . . 0.0 110.182 162.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -77.54 -20.06 54.74 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.468 -2.02 . . . . 0.0 112.456 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.58 -24.23 61.87 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.928 -1.732 . . . . 0.0 112.909 166.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -80.49 -47.36 14.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.373 1.869 . . . . 0.0 108.35 175.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -53.3 -21.27 5.29 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.716 2.806 . . . . 0.0 114.31 171.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -68.29 -24.67 64.89 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 118.675 -2.516 . . . . 0.0 113.169 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.94 19.2 14.46 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.066 -1.021 . . . . 0.0 112.92 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -27.74 -35.39 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 1 N-CA-C 122.693 4.331 . . . . 0.0 122.693 -178.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -124.61 -27.62 1.27 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.266 1.413 . . . . 0.0 114.452 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 ptmm? -92.06 -5.8 52.18 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.249 -1.736 . . . . 0.0 112.887 -175.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.8 m -26.3 -63.3 0.07 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 131.178 3.791 . . . . 0.0 117.36 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -15.31 63.53 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 -166.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -93.04 -40.3 10.6 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.613 1.165 . . . . 0.0 111.837 172.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.75 -31.18 15.16 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.172 -1.58 . . . . 0.0 113.387 -168.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.07 -62.51 1.61 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.032 1.333 . . . . 0.0 112.69 174.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -42.21 -44.74 3.87 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -87.16 -25.38 24.11 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.009 -1.682 . . . . 0.0 113.726 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -79.07 -35.47 42.39 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.553 -1.342 . . . . 0.0 110.343 169.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -58.84 -50.88 72.32 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.4 tt -38.61 -52.98 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 172.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.8 -21.44 51.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.9 mt -74.53 -50.26 18.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.61 -1.306 . . . . 0.0 111.154 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 37.6 t -67.41 -23.4 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.308 1.843 . . . . 0.0 110.712 -174.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -46.37 81.01 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.451 -1.406 . . . . 0.0 113.745 166.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -74.72 -26.1 59.58 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.274 1.83 . . . . 0.0 113.451 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -64.92 -59.73 3.85 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.413 -1.429 . . . . 0.0 107.767 168.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.15 -34.17 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 C-N-CA 125.244 1.418 . . . . 0.0 114.467 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.27 -31.92 54.91 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 171.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -87.4 -49.71 7.05 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.744 -1.222 . . . . 0.0 110.223 168.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -93.79 -10.79 33.0 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -152.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.8 t -57.64 -56.02 27.27 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.616 -1.302 . . . . 0.0 114.36 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.26 1.644 0 O-C-N 121.467 -0.77 . . . . 0.0 108.976 172.759 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 CA--C 1.491 -1.314 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -71.85 -23.82 61.59 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.537 2.735 . . . . 0.0 113.989 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -72.6 -46.89 52.0 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.436 -1.415 . . . . 0.0 112.138 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 62.8 tp -61.87 -43.43 98.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.33 1.452 . . . . 0.0 111.303 178.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.414 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 31.7 t80 -44.44 -48.85 9.97 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.748 2.019 . . . . 0.0 112.585 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -83.41 -27.4 29.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.945 -1.097 . . . . 0.0 112.961 -176.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -61.7 -53.59 54.03 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.877 -1.139 . . . . 0.0 112.039 169.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -86.01 -21.54 27.74 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.017 -1.677 . . . . 0.0 114.579 -173.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.474 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -64.64 -47.47 78.41 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 124.351 2.024 . . . . 0.0 113.596 176.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -60.96 -22.04 64.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.628 1.971 . . . . 0.0 113.367 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.48 -58.37 3.33 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.27 1.028 . . . . 0.0 110.731 168.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 m -64.41 -26.69 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 119.972 -1.705 . . . . 0.0 114.241 -172.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -76.26 -11.01 59.84 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 175.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -128.13 -2.79 5.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.946 1.299 . . . . 0.0 112.593 -171.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 tp -68.46 150.5 97.67 Favored Pre-proline 0 N--CA 1.43 -1.432 0 O-C-N 119.327 -2.108 . . . . 0.0 111.713 -174.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -74.79 -10.9 21.81 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.876 3.051 . . . . 0.0 112.182 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 55.0 m -109.63 80.1 1.28 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 164.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -58.96 145.0 81.09 Favored Pre-proline 0 N--CA 1.429 -1.482 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.847 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -67.79 157.25 62.63 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.531 2.154 . . . . 0.0 113.904 -153.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 t -72.48 135.42 45.69 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.762 -1.212 . . . . 0.0 111.243 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.6 t -53.56 -36.89 62.35 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -68.01 -41.99 81.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.231 1.812 . . . . 0.0 112.912 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.58 -48.8 65.82 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.263 1.425 . . . . 0.0 110.12 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.0 tt -48.75 -37.8 19.95 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.754 2.422 . . . . 0.0 116.473 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.91 -57.94 6.44 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -67.71 -40.95 84.22 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.597 1.159 . . . . 0.0 111.159 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.09 -31.46 70.19 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.122 1.769 . . . . 0.0 113.247 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.66 -54.82 33.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.755 1.622 . . . . 0.0 108.724 168.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.21 -48.1 65.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.13 -46.43 81.01 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 174.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 21.4 t80 -55.88 -50.55 70.34 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.119 1.437 . . . . 0.0 111.051 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -64.23 -36.86 85.44 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.359 -1.463 . . . . 0.0 112.866 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -53.24 -60.07 3.76 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.883 1.219 . . . . 0.0 113.914 176.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -93.67 -0.29 56.14 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.0 113.668 -176.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.9 m -69.41 -64.34 0.89 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.278 -1.514 . . . . 0.0 111.502 161.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.84 -45.49 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.676 -1.265 . . . . 0.0 114.17 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 108.14 -31.53 7.83 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.084 -1.635 . . . . 0.0 113.69 -175.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.66 164.88 26.52 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.345 1.058 . . . . 0.0 108.799 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -48.32 103.61 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 157.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -92.36 -81.36 0.34 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.67 1.188 . . . . 0.0 111.046 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.7 81.7 8.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.002 1.721 . . . . 0.0 111.93 -171.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -83.26 64.76 7.92 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.907 1.813 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -159.26 68.42 3.21 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 127.187 2.195 . . . . 0.0 107.453 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.82 152.92 47.7 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.688 2.353 . . . . 0.0 107.554 158.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.47 -170.22 33.98 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.56 -1.962 . . . . 0.0 114.934 -168.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.3 pt -102.46 -47.11 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.651 -1.499 . . . . 0.0 109.513 -162.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -84.65 -7.64 59.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.95 2.1 . . . . 0.0 109.917 167.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -76.67 70.35 3.16 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.566 1.146 . . . . 0.0 113.216 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -58.18 -33.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.013 2.125 . . . . 0.0 113.958 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -66.52 -62.31 1.53 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.104 1.362 . . . . 0.0 111.717 175.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.68 -32.55 65.53 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -50.99 -50.71 57.8 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 169.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.286 17.1 p90 -74.02 -36.39 64.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.42 -1.425 . . . . 0.0 113.921 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -53.25 -50.24 65.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.739 1.216 . . . . 0.0 112.873 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -73.41 -33.75 65.12 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.083 0.953 . . . . 0.0 113.342 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -69.7 -38.09 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.02 -1.675 . . . . 0.0 111.914 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.98 -17.83 62.63 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.99 1.316 . . . . 0.0 112.974 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -88.89 -44.88 10.14 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.84 1.656 . . . . 0.0 109.103 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -57.41 -16.62 9.77 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.557 2.343 . . . . 0.0 113.681 175.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -67.08 -26.03 66.52 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.146 -2.846 . . . . 0.0 114.21 170.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -117.26 10.68 13.83 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.469 -1.394 . . . . 0.0 111.938 -175.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.84 -1.43 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.487 2 C-N-CA 134.904 5.282 . . . . 0.0 123.555 -172.256 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -168.5 4.91 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.734 0 O-C-N 119.491 -2.006 . . . . 0.0 111.803 173.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -106.77 -55.89 2.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.462 1.601 . . . . 0.0 108.178 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 68' ' ' ASP . 67.5 m -86.53 34.15 0.64 Allowed 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.748 -1.569 . . . . 0.0 114.712 -161.503 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -55.01 -33.08 62.3 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.962 -1.712 . . . . 0.0 111.923 150.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.35 -49.01 37.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 129.678 3.191 . . . . 0.0 112.209 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.411 ' HB2' ' HB3' ' A' ' 65' ' ' SER . 22.8 m-20 -75.45 -42.54 53.03 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.633 -0.667 . . . . 0.0 112.731 176.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.44 -62.38 0.98 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 175.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.52 -28.23 8.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 120.108 3.374 . . . . 0.0 120.108 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 mmtt -88.85 -38.76 14.34 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.912 2.085 . . . . 0.0 113.386 179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.46 -23.5 24.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.318 -1.489 . . . . 0.0 111.265 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -65.61 -48.5 72.08 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.239 -1.538 . . . . 0.0 113.82 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.9 tt -38.79 -54.26 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 167.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.01 -18.14 58.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.3 mt -76.71 -53.58 7.79 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.822 -1.799 . . . . 0.0 110.447 168.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 40.9 t -69.53 -26.79 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.611 1.964 . . . . 0.0 112.017 -168.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.31 -38.15 90.02 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 0.0 112.913 170.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -80.29 -16.04 55.56 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.379 1.071 . . . . 0.0 113.22 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.76 -62.2 1.48 Allowed 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.686 . . . . 0.0 107.941 164.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.27 -33.0 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 125.346 1.458 . . . . 0.0 113.517 -173.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.36 59.85 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -86.96 -45.41 10.82 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.92 -1.113 . . . . 0.0 110.436 169.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.5 m-30 -90.36 -12.79 36.6 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -153.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.4 p -43.98 -54.84 5.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.1 p . . . . . 0 C--O 1.26 1.63 0 O-C-N 120.888 -1.132 . . . . 0.0 110.755 170.14 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.711 0.767 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -73.93 -18.58 60.88 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.825 -1.797 . . . . 0.0 113.408 -174.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -78.72 -45.94 20.09 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.858 -1.776 . . . . 0.0 112.266 171.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.4 tp -63.24 -37.03 85.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.691 -1.256 . . . . 0.0 110.645 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.401 ' CE1' ' HB1' ' A' ' 34' ' ' ALA . 73.9 t80 -44.24 -46.69 9.14 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.906 1.682 . . . . 0.0 112.276 172.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.09 -41.86 21.88 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.868 -1.145 . . . . 0.0 111.946 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.8 -46.31 78.03 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.672 1.189 . . . . 0.0 112.907 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -88.34 -28.02 21.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -178.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.449 ' HB3' ' CD1' ' A' ' 31' ' ' TYR . . . -67.4 -48.09 68.37 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.307 -2.12 . . . . 0.0 113.552 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.03 -15.8 63.95 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.112 0.965 . . . . 0.0 113.39 173.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.4 -54.21 8.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.121 -0.987 . . . . 0.0 111.265 166.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.8 m -68.23 -33.04 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.741 1.216 . . . . 0.0 113.699 -174.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -77.64 -6.22 53.06 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.9 -1.125 . . . . 0.0 113.544 176.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -121.35 2.38 10.26 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.552 1.141 . . . . 0.0 112.642 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 tp -71.45 156.18 91.82 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 119.398 -2.064 . . . . 0.0 112.18 -167.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -75.26 -21.49 15.32 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.981 2.458 . . . . 0.0 111.017 -177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.5 m -96.22 63.15 2.19 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -51.53 144.32 17.73 Favored Pre-proline 0 N--CA 1.429 -1.505 0 C-N-CA 127.856 2.462 . . . . 0.0 114.163 -170.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -59.21 136.76 74.74 Favored 'Trans proline' 0 N--CA 1.434 -2.022 0 CA-C-N 124.426 2.616 . . . . 0.0 118.228 -153.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 m -77.61 147.64 35.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.902 1.281 . . . . 0.0 111.95 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.26 12.3 t -62.1 -45.79 91.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 -158.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.68 -28.4 60.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.76 -1.837 . . . . 0.0 112.717 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.81 -44.14 33.72 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.713 1.605 . . . . 0.0 110.979 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -47.75 -38.78 16.22 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.999 2.52 . . . . 0.0 116.068 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.9 -45.12 87.29 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -66.79 -44.95 79.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.696 1.199 . . . . 0.0 110.399 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.76 -42.34 97.26 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.286 2.234 . . . . 0.0 113.539 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -49.58 -55.48 13.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.826 2.45 . . . . 0.0 111.716 171.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.47 -50.29 32.09 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 178.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 69' ' ' ALA . 2.7 mm? -77.4 -38.72 49.26 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -177.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.449 ' CD1' ' HB3' ' A' ' 9' ' ' ALA . 26.0 t80 -61.31 -56.31 21.91 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.866 -1.771 . . . . 0.0 111.299 175.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.5 mmmt -57.66 -40.12 78.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.523 -1.986 . . . . 0.0 112.816 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . 20.8 mt-30 -46.15 -61.57 1.71 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 171.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.401 ' HB1' ' CE1' ' A' ' 5' ' ' PHE . . . -85.44 -14.64 45.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.783 -1.198 . . . . 0.0 112.718 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.0 m -60.3 -60.26 4.1 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.227 0.922 . . . . 0.0 112.188 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.06 -47.16 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.905 -1.122 . . . . 0.0 113.104 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.85 4.83 45.17 Favored Glycine 0 N--CA 1.43 -1.731 0 O-C-N 121.105 -0.997 . . . . 0.0 114.607 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -144.51 169.09 18.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -72.94 88.59 1.37 Allowed 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.185 1.469 . . . . 0.0 112.641 158.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -72.83 -75.54 0.14 Allowed 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.199 -1.563 . . . . 0.0 113.862 -175.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.6 ttmm -86.45 81.39 8.33 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 -150.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -81.45 36.81 0.44 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.926 2.09 . . . . 0.0 112.046 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.08 71.27 75.73 Favored Pre-proline 0 N--CA 1.43 -1.442 0 C-N-CA 126.411 1.885 . . . . 0.0 108.84 166.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -84.25 -158.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 123.191 2.594 . . . . 0.0 111.273 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.37 -178.53 47.91 Favored Glycine 0 N--CA 1.429 -1.81 0 CA-C-N 121.881 2.128 . . . . 0.0 114.561 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.5 pt -105.28 -47.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 121.44 -1.035 . . . . 0.0 109.284 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.89 33.32 4.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.369 1.868 . . . . 0.0 110.617 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -82.71 146.35 29.09 Favored 'General case' 0 N--CA 1.429 -1.504 0 O-C-N 119.177 -2.202 . . . . 0.0 110.388 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.2 tpt -98.67 -35.58 10.14 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.175 -1.578 . . . . 0.0 108.998 170.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -74.34 -31.89 62.59 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -175.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -35.1 76.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.898 -1.751 . . . . 0.0 113.746 176.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.9 mmt85 -60.06 -21.1 60.99 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.294 2.238 . . . . 0.0 113.75 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -91.41 -58.76 2.34 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.956 163.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -55.11 -58.0 9.43 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.62 1.968 . . . . 0.0 115.845 -173.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -78.48 -27.22 46.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.191 -0.943 . . . . 0.0 110.453 -167.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -73.08 -35.68 66.68 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.049 -1.657 . . . . 0.0 112.256 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.76 -29.17 69.07 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.107 -0.996 . . . . 0.0 113.038 172.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.458 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.0 t90 -75.8 -52.95 9.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.162 1.385 . . . . 0.0 111.805 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -55.6 -29.46 59.16 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 131.091 3.756 . . . . 0.0 113.053 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -54.48 -40.7 68.72 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.785 1.234 . . . . 0.0 113.11 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.56 46.27 0.98 Allowed 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.639 1.209 . . . . 0.0 111.877 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.06 -47.13 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.436 1 N-CA-C 123.564 4.653 . . . . 0.0 123.564 167.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.87 -16.44 0.51 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 121.396 1.907 . . . . 0.0 113.113 -160.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -104.71 11.1 34.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.397 2.046 . . . . 0.0 110.289 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -46.11 -47.87 17.28 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 129.399 3.079 . . . . 0.0 116.188 -174.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.67 -16.94 60.75 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.369 -1.457 . . . . 0.0 114.133 -174.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -93.36 -38.72 11.32 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.688 1.595 . . . . 0.0 112.858 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -87.82 -40.24 14.19 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.778 -1.201 . . . . 0.0 111.251 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HA ' HD11 ' A' ' 30' ' ' LEU . . . -54.94 -58.54 7.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.413 ' CD ' ' HZ3' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -43.42 -27.69 0.29 Allowed 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 172.255 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.413 ' HZ3' ' CD ' ' A' ' 70' ' ' GLU . 14.0 mptt -88.52 -39.56 14.08 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.707 2.003 . . . . 0.0 112.996 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.49 -21.74 48.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.594 -0.691 . . . . 0.0 111.571 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -68.28 -52.3 35.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.793 1.237 . . . . 0.0 112.09 -167.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.5 tt -40.28 -50.56 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 166.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.33 -30.14 63.15 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.7 mt -67.33 -53.51 28.9 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.872 -1.767 . . . . 0.0 111.577 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 24.3 t -74.53 -24.79 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 125.566 1.546 . . . . 0.0 111.172 -167.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.65 -30.54 71.26 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.419 -2.05 . . . . 0.0 112.873 170.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.52 -13.38 54.69 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.63 -1.294 . . . . 0.0 113.058 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.7 mp -78.25 -63.35 1.42 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.168 -1.583 . . . . 0.0 108.068 163.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.2 mm -50.85 -39.79 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 128.55 2.74 . . . . 0.0 114.467 -174.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.15 -34.23 65.95 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 172.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? -87.53 -38.66 15.82 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.257 -1.527 . . . . 0.0 112.29 166.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -91.83 -30.84 15.98 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.236 -1.54 . . . . 0.0 113.701 -156.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.0 p -35.01 -54.79 0.59 Allowed 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 C--O 1.26 1.611 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 171.512 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -75.21 -23.01 57.55 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.469 -2.019 . . . . 0.0 114.699 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -85.58 -44.62 12.48 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.594 -1.316 . . . . 0.0 109.753 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.9 tp -52.06 -45.74 64.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.849 2.86 . . . . 0.0 110.692 178.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 19.3 t80 -43.28 -49.2 6.79 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 128.603 2.761 . . . . 0.0 111.091 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -80.17 -39.46 29.26 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 121.161 -0.962 . . . . 0.0 112.767 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.48 -40.08 92.71 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.483 -1.386 . . . . 0.0 113.268 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -82.41 -27.63 31.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.496 1.118 . . . . 0.0 112.633 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.412 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -63.48 -45.25 91.59 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.64 -1.912 . . . . 0.0 114.428 173.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -61.29 -26.72 67.97 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.332 1.453 . . . . 0.0 112.828 174.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.09 -59.07 2.93 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 123.813 0.845 . . . . 0.0 110.592 170.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.8 m -61.38 -31.21 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 O-C-N 120.487 -1.383 . . . . 0.0 113.589 -169.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -70.78 -21.11 62.54 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -127.2 22.97 6.53 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.864 1.266 . . . . 0.0 112.224 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.5 mt -71.73 157.21 90.15 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 119.4 -2.063 . . . . 0.0 110.911 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.88 -24.13 13.4 Favored 'Trans proline' 0 C--N 1.299 -2.038 0 C-N-CA 123.166 2.578 . . . . 0.0 110.676 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.7 m -105.11 80.88 1.66 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 171.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -58.51 157.32 18.86 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 126.259 1.824 . . . . 0.0 114.356 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -68.31 149.02 75.23 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 122.869 2.379 . . . . 0.0 112.186 -171.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -71.38 145.07 49.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 120.022 1.283 . . . . 0.0 113.326 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 49.4 m -36.14 -59.95 0.58 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.138 3.375 . . . . 0.0 117.192 -168.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -84.36 -32.82 24.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.615 -1.303 . . . . 0.0 111.165 -173.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.41 -36.84 82.07 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.526 1.531 . . . . 0.0 111.032 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -50.53 -31.26 15.06 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 127.029 2.131 . . . . 0.0 115.255 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.53 -38.88 74.29 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.965 -1.709 . . . . 0.0 113.177 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -65.47 -46.1 81.12 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.589 1.185 . . . . 0.0 111.359 173.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.23 -34.52 78.21 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.235 1.414 . . . . 0.0 113.138 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -56.93 -59.69 4.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.311 1.844 . . . . 0.0 111.184 167.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.95 -44.39 60.45 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mp -66.91 -52.24 45.57 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.412 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 12.6 t80 -54.97 -52.28 63.55 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-O 124.054 1.883 . . . . 0.0 111.439 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.9 mmmt -61.58 -31.95 72.03 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.363 1.465 . . . . 0.0 113.016 172.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -63.52 -61.33 2.4 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.91 -1.743 . . . . 0.0 115.414 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.305 . . -84.26 0.13 50.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -179.372 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -74.68 -61.31 1.92 Allowed 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.748 -1.845 . . . . 0.0 112.185 155.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.9 t -77.68 -55.03 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.022 -1.674 . . . . 0.0 113.024 -172.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.97 -0.26 62.39 Favored Glycine 0 N--CA 1.432 -1.611 0 C-N-CA 127.132 2.301 . . . . 0.0 114.168 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -136.99 173.0 12.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 166.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.417 ' HA ' ' CE2' ' A' ' 58' ' ' TRP . 35.3 p-10 -72.52 118.52 15.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.619 -1.301 . . . . 0.0 111.864 152.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.3 t0 -79.94 -81.04 0.12 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.106 -1.621 . . . . 0.0 113.42 -168.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -87.96 92.42 9.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.548 1.139 . . . . 0.0 112.326 -162.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -78.01 49.45 0.8 Allowed 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 124.187 1.946 . . . . 0.0 112.827 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 tttt -160.26 89.34 1.8 Allowed Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 127.026 2.13 . . . . 0.0 107.349 167.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.4 161.88 36.92 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.454 2.103 . . . . 0.0 108.953 159.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.41 166.53 54.73 Favored Glycine 0 N--CA 1.43 -1.719 0 CA-C-N 120.797 1.635 . . . . 0.0 114.24 -166.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.0 pt -84.81 -36.93 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 120.649 -1.501 . . . . 0.0 111.346 -152.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -111.11 24.64 12.65 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.387 2.275 . . . . 0.0 109.537 169.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -84.44 97.9 9.77 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.561 -1.337 . . . . 0.0 111.924 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -71.78 -11.44 60.82 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -174.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -92.32 -63.78 1.19 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.566 -1.334 . . . . 0.0 110.082 171.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.25 -30.44 71.49 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -165.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -55.63 -35.02 65.45 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 124.673 1.189 . . . . 0.0 114.11 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -82.26 -47.63 12.19 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.96 1.704 . . . . 0.0 110.658 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -57.34 -48.37 79.18 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.764 1.226 . . . . 0.0 112.688 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -70.51 -30.91 67.8 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.118 -0.989 . . . . 0.0 113.509 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -73.39 -34.95 65.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.685 -1.884 . . . . 0.0 112.002 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.93 72.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.253 -1.529 . . . . 0.0 112.958 171.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.518 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.8 t90 -67.91 -37.39 81.64 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.771 1.228 . . . . 0.0 112.496 173.473 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -24.28 67.18 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.121 2.168 . . . . 0.0 114.101 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -72.07 -20.97 61.58 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 118.752 -2.467 . . . . 0.0 113.04 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.427 ' HB3' ' HB2' ' A' ' 65' ' ' SER . 18.0 mt -101.06 -0.57 36.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.527 1.131 . . . . 0.0 113.728 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -26.44 -25.1 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 2 N-CA-C 124.694 5.072 . . . . 0.0 124.694 -158.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -165.5 27.42 0.19 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 119.389 -2.069 . . . . 0.0 110.952 167.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -117.24 -52.68 2.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.173 0.987 . . . . 0.0 110.03 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.427 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . 2.4 m -82.91 36.12 0.49 Allowed 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -164.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -73.72 -28.96 61.98 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 127.055 2.142 . . . . 0.0 108.728 163.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.25 -43.35 78.05 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 129.396 3.079 . . . . 0.0 111.154 175.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -80.39 -39.72 27.88 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 118.48 -0.771 . . . . 0.0 111.978 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.59 -61.88 1.12 Allowed 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 174.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -46.47 -47.92 19.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 118.729 2.863 . . . . 0.0 118.729 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -88.2 -29.35 20.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.773 -1.83 . . . . 0.0 113.978 -170.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -89.87 -22.29 22.12 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.596 -1.315 . . . . 0.0 110.594 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.423 ' CE2' HG22 ' A' ' 77' ' ' VAL . 24.7 t80 -67.74 -48.37 66.62 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.1 -51.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 167.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.44 -32.93 72.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.1 -49.86 68.34 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.873 -1.142 . . . . 0.0 112.452 171.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.423 HG22 ' CE2' ' A' ' 73' ' ' TYR . 43.8 t -71.96 -21.37 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 C-N-CA 125.617 1.567 . . . . 0.0 111.151 -171.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -62.63 -43.56 98.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.703 -1.873 . . . . 0.0 114.014 163.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.01 -15.56 62.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.316 1.446 . . . . 0.0 113.734 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.2 mp -81.94 -65.21 1.04 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.351 1.86 . . . . 0.0 109.953 170.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.0 mt -65.94 -29.66 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.557 -1.339 . . . . 0.0 112.863 -165.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.22 -37.82 49.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.719 -1.238 . . . . 0.0 114.292 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -87.56 -39.57 15.0 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.699 1.199 . . . . 0.0 111.38 174.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -98.92 -13.84 19.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -156.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.49 -54.37 44.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.261 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 109.959 173.082 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 115.335 1.606 . . . . 0.0 115.335 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 p -59.23 -30.69 68.43 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 128.94 2.896 . . . . 0.0 114.438 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -58.2 -37.69 75.28 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.77 -50.77 65.51 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 123.455 1.597 . . . . 0.0 111.552 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -49.6 -36.61 24.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.962 2.505 . . . . 0.0 111.2 172.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -81.39 -26.36 35.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.639 -1.288 . . . . 0.0 113.359 -178.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -64.71 -53.11 52.42 Favored 'General case' 0 N--CA 1.428 -1.529 0 O-C-N 119.829 -1.794 . . . . 0.0 111.43 166.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -68.05 -43.48 78.57 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.037 2.135 . . . . 0.0 112.861 -171.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.477 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.76 -46.18 69.45 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 124.203 1.954 . . . . 0.0 113.524 -171.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt -65.87 -16.63 64.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.54 -1.664 . . . . 0.0 113.325 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.75 -55.76 5.06 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.158 0.89 . . . . 0.0 111.44 165.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.28 -25.9 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 119.854 -1.779 . . . . 0.0 114.035 -171.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -72.73 -10.89 60.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -148.22 29.25 0.88 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.935 1.35 . . . . 0.0 112.996 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 tp -73.52 165.15 55.63 Favored Pre-proline 0 N--CA 1.429 -1.505 0 O-C-N 119.965 -1.709 . . . . 0.0 108.802 172.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -74.56 -28.96 9.55 Favored 'Trans proline' 0 N--CA 1.433 -2.079 0 CA-C-N 124.718 2.721 . . . . 0.0 110.919 178.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.6 m -103.0 78.77 1.68 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 104.024 -2.584 . . . . 0.0 104.024 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -64.75 152.81 89.41 Favored Pre-proline 0 N--CA 1.43 -1.474 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -67.52 150.15 80.14 Favored 'Trans proline' 0 C--N 1.301 -1.964 0 C-N-CA 122.924 2.416 . . . . 0.0 114.009 -161.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 t -81.04 174.54 11.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.661 1.119 . . . . 0.0 113.86 -171.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -57.55 -55.82 29.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.123 1.769 . . . . 0.0 114.595 -170.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -67.84 -31.03 70.58 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.408 1.883 . . . . 0.0 113.005 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -71.7 -59.87 2.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.44 1.896 . . . . 0.0 110.451 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.5 tp -49.25 -27.08 3.41 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.794 2.438 . . . . 0.0 117.129 -177.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.2 mt -61.23 -58.36 8.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.507 -1.371 . . . . 0.0 114.307 167.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -74.6 -35.16 62.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.188 0.994 . . . . 0.0 112.275 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.54 -32.6 73.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.643 1.577 . . . . 0.0 112.268 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -60.71 -55.24 35.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.425 -1.422 . . . . 0.0 110.867 164.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.04 -54.23 26.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 124.632 1.173 . . . . 0.0 112.598 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mp -63.04 -41.09 99.42 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 174.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.477 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 34.1 t80 -61.53 -53.4 56.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.828 -1.17 . . . . 0.0 112.153 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' HB3' ' CE2' ' A' ' 58' ' ' TRP . 21.0 mmmt -53.79 -41.66 67.48 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.465 -2.022 . . . . 0.0 112.647 170.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -54.98 -60.66 3.06 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 124.576 1.151 . . . . 0.0 113.689 178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -89.29 -6.84 56.43 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.058 -1.651 . . . . 0.0 112.986 -175.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -68.27 -67.38 0.47 Allowed 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.492 -1.38 . . . . 0.0 111.49 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.35 -27.33 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.822 -1.174 . . . . 0.0 113.898 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.16 -17.73 57.67 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.065 -1.647 . . . . 0.0 115.553 171.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -135.14 166.59 22.73 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -56.45 85.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 151.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -77.52 -67.4 0.72 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.684 1.994 . . . . 0.0 113.475 -167.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 158.32 18.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -131.96 17.16 4.65 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 124.791 2.234 . . . . 0.0 107.726 172.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 96.64 46.86 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 125.855 1.662 . . . . 0.0 108.435 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.0 -165.33 0.32 Allowed 'Trans proline' 0 C--N 1.3 -2.01 0 C-N-CA 122.744 2.296 . . . . 0.0 111.249 166.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.26 174.68 9.44 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 117.255 1.662 . . . . 0.0 117.255 -175.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.4 pt -86.66 -46.73 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.174 -1.78 . . . . 0.0 112.304 -167.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -85.47 -5.24 59.31 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.27 2.228 . . . . 0.0 111.848 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.298 0.1 OUTLIER -17.02 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 121.784 3.994 . . . . 0.0 121.784 -170.064 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.3 mtt -93.48 -54.92 3.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.7 -1.25 . . . . 0.0 107.785 163.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.9 mttm -72.47 -42.06 65.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.627 -1.296 . . . . 0.0 114.313 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -62.13 -34.37 76.23 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.26 -18.01 61.27 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.983 -1.698 . . . . 0.0 114.446 -176.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -76.44 -50.1 14.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.106 -0.996 . . . . 0.0 111.131 166.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.89 -51.04 68.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.439 1.496 . . . . 0.0 114.248 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -66.26 -36.74 83.79 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.516 1.126 . . . . 0.0 112.681 -178.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -74.03 -32.38 63.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.522 -1.986 . . . . 0.0 112.434 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -25.68 67.3 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.108 -1.62 . . . . 0.0 112.793 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.408 ' CE2' ' HB3' ' A' ' 32' ' ' LYS . 17.9 t90 -80.07 -49.34 11.9 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.964 2.506 . . . . 0.0 110.223 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -12.48 40.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.713 2.005 . . . . 0.0 114.181 -179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -72.09 -21.58 61.48 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.625 -1.922 . . . . 0.0 113.846 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 mp -114.92 14.69 17.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.86 -1.15 . . . . 0.0 113.207 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.94 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 1 N-CA-C 122.997 4.443 . . . . 0.0 122.997 177.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -102.36 -47.83 1.38 Allowed Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 126.274 1.892 . . . . 0.0 112.366 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -86.96 -6.11 58.87 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.819 -1.401 . . . . 0.0 113.401 -170.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 m -28.04 -61.44 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 129.468 3.107 . . . . 0.0 118.47 -175.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.4 -14.56 63.03 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -92.52 -44.56 8.57 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.703 1.201 . . . . 0.0 110.239 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -36.15 12.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -167.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.17 -53.12 61.95 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -41.08 -39.64 1.29 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 119.352 3.093 . . . . 0.0 119.352 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.5 mttp -88.25 -34.96 17.56 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.824 -1.797 . . . . 0.0 113.835 -176.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -77.53 -29.41 52.31 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.84 -1.162 . . . . 0.0 110.972 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -66.83 -45.93 76.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.383 -1.448 . . . . 0.0 113.959 -173.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.5 tp -47.11 -45.83 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.05 -39.87 87.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.35 -42.63 96.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.454 1.102 . . . . 0.0 113.099 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 49.8 t -77.32 -23.98 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.531 1.532 . . . . 0.0 111.096 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -63.36 -42.35 98.89 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.32 -2.113 . . . . 0.0 112.068 168.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -65.51 -26.97 68.14 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.356 1.463 . . . . 0.0 113.855 173.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mt -72.46 -63.1 1.22 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.219 1.408 . . . . 0.0 109.294 171.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.0 mt -64.45 -31.03 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.539 1.536 . . . . 0.0 113.185 -169.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.74 -30.01 60.5 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 170.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -87.65 -48.32 7.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.045 -1.035 . . . . 0.0 110.989 165.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -95.0 -12.23 27.03 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -149.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -46.31 -54.72 8.42 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.961 1.704 . . . . 0.0 114.523 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.26 1.614 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 166.303 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.322 12.1 m . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -64.92 -23.38 67.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.326 2.33 . . . . 0.0 114.967 -171.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -77.88 -43.4 30.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.44 -1.413 . . . . 0.0 112.339 173.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.36 -44.06 95.95 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.83 1.652 . . . . 0.0 110.725 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.439 ' CE1' ' HB1' ' A' ' 34' ' ' ALA . 16.2 t80 -44.06 -40.01 4.57 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 128.074 2.55 . . . . 0.0 112.496 174.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -74.92 -46.05 38.43 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.092 -1.005 . . . . 0.0 111.71 178.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -58.49 -40.21 82.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.365 1.079 . . . . 0.0 113.858 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -65.89 -50.71 63.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.023 2.529 . . . . 0.0 112.299 172.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.438 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.33 -49.89 57.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 124.274 1.988 . . . . 0.0 114.531 -167.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -65.99 -14.79 62.26 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 113.185 -1.825 . . . . 0.0 113.789 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.27 -60.36 2.33 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 110.668 161.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 24.0 m -65.83 -28.84 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 120.069 -1.645 . . . . 0.0 114.929 -168.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.93 -14.49 60.25 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.075 -1.016 . . . . 0.0 113.026 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -106.53 -32.78 7.92 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.589 1.955 . . . . 0.0 113.538 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.32 154.95 0.59 Allowed Pre-proline 0 N--CA 1.43 -1.425 0 C-N-CA 129.787 3.235 . . . . 0.0 116.464 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.16 -14.95 20.64 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.847 2.365 . . . . 0.0 111.874 -174.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 56.1 m -111.79 76.3 0.97 Allowed 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.091 -2.929 . . . . 0.0 103.091 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -57.56 144.19 73.1 Favored Pre-proline 0 N--CA 1.431 -1.424 0 C-N-CA 124.444 1.098 . . . . 0.0 113.72 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -65.31 140.63 65.0 Favored 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 122.987 2.458 . . . . 0.0 112.811 -157.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.3 m -65.72 153.96 40.28 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 120.606 1.548 . . . . 0.0 113.804 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.4 m -40.93 -56.8 2.15 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 128.34 2.656 . . . . 0.0 116.805 -168.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.6 -33.38 66.67 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.926 1.69 . . . . 0.0 113.342 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -76.37 -46.78 25.89 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.714 1.606 . . . . 0.0 110.191 -175.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.1 tp -44.42 -38.22 3.9 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.251 2.221 . . . . 0.0 115.991 172.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -42.59 57.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -176.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.28 -26.7 58.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.314 -1.491 . . . . 0.0 111.231 176.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -72.06 -37.79 69.58 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.591 -1.318 . . . . 0.0 112.865 171.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -54.15 -51.99 62.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.023 1.729 . . . . 0.0 111.83 168.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.96 -49.06 51.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -67.6 -46.79 71.58 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.438 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 35.0 t80 -54.69 -53.04 60.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.249 1.5 . . . . 0.0 111.186 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 24.9 mmmt -64.99 -29.94 70.9 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 118.77 -2.456 . . . . 0.0 112.805 176.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -64.03 -53.18 54.01 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.439 ' HB1' ' CE1' ' A' ' 5' ' ' PHE . . . -86.29 -11.01 53.4 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.623 -1.923 . . . . 0.0 112.552 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 m -69.26 -53.77 18.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.485 -1.384 . . . . 0.0 112.179 166.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 46.3 t -86.82 -62.05 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 O-C-N 120.631 -1.293 . . . . 0.0 112.708 -178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.3 -26.62 10.96 Favored Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 128.346 2.879 . . . . 0.0 112.153 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -119.09 -176.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 170.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -67.51 123.29 20.0 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.745 -1.847 . . . . 0.0 110.792 146.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -80.96 -62.15 1.75 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.796 -1.815 . . . . 0.0 110.438 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -83.55 166.01 18.6 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -143.06 43.4 1.56 Allowed 'General case' 0 N--CA 1.43 -1.425 0 CA-C-O 124.08 1.895 . . . . 0.0 105.938 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -149.9 86.18 5.38 Favored Pre-proline 0 N--CA 1.429 -1.48 0 O-C-N 120.712 -1.243 . . . . 0.0 110.41 174.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.58 179.29 5.72 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.336 2.024 . . . . 0.0 109.548 155.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.92 -173.8 38.88 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.809 -1.807 . . . . 0.0 113.951 -173.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 pt -96.6 -50.42 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.962 -1.316 . . . . 0.0 108.954 -168.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -101.12 4.69 42.36 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.313 1.445 . . . . 0.0 110.674 168.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.51 83.28 3.2 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.878 -1.139 . . . . 0.0 112.516 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.3 tpt -64.24 -38.74 92.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.259 -1.526 . . . . 0.0 112.748 -172.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -65.14 -49.47 69.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.322 1.449 . . . . 0.0 113.518 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -62.13 -42.62 99.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.347 -1.471 . . . . 0.0 111.903 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp85 -56.92 -46.9 81.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 177.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.298 8.3 p90 -71.5 -35.95 70.93 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.707 1.594 . . . . 0.0 114.408 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -62.77 -45.72 91.37 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.652 -1.28 . . . . 0.0 112.029 173.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -66.0 -31.28 72.09 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.574 1.15 . . . . 0.0 113.037 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.92 -34.42 75.35 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.702 -1.874 . . . . 0.0 111.926 176.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -23.71 61.06 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.205 -1.56 . . . . 0.0 113.88 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.437 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 16.3 t90 -82.66 -43.88 16.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.124 1.37 . . . . 0.0 111.333 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -21.42 66.58 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.657 -1.277 . . . . 0.0 113.692 -178.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.24 -31.17 63.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.483 -1.386 . . . . 0.0 113.463 166.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 65' ' ' SER . 77.3 mt -105.7 -0.13 25.77 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.476 1.11 . . . . 0.0 113.913 -174.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -30.73 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.411 2 N-CA-C 125.446 5.35 . . . . 0.0 125.446 -162.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.61 15.93 0.19 Allowed Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 122.04 2.2 . . . . 0.0 114.479 169.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -116.82 -52.18 2.55 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 119.545 1.673 . . . . 0.0 110.867 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.409 ' HB2' ' HB3' ' A' ' 61' ' ' LEU . 39.7 m -85.78 43.44 1.04 Allowed 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -161.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.15 -33.56 65.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.793 1.637 . . . . 0.0 107.648 155.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.09 -37.35 84.74 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.955 2.902 . . . . 0.0 110.809 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -86.84 -45.68 10.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.018 1.327 . . . . 0.0 111.284 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.15 -61.39 1.33 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -49.69 -37.4 28.7 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 119.525 3.158 . . . . 0.0 119.525 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -88.47 -31.43 18.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.502 -1.999 . . . . 0.0 114.99 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -83.62 -25.8 30.51 Favored 'General case' 0 N--CA 1.428 -1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.404 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -66.25 -46.53 76.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -42.69 -52.75 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 170.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.69 -25.45 62.11 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.83 -51.83 24.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.787 -1.195 . . . . 0.0 110.983 170.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.405 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 77.9 t -70.62 -26.91 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.806 1.242 . . . . 0.0 111.597 -169.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -55.01 -42.13 72.17 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.475 -1.391 . . . . 0.0 113.379 167.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -78.77 -26.06 44.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.806 1.242 . . . . 0.0 114.135 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 6.7 mp -67.18 -56.37 10.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.386 1.474 . . . . 0.0 109.421 170.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -66.64 -31.21 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.829 -1.17 . . . . 0.0 112.479 -171.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.67 -34.44 38.27 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 168.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -86.9 -47.67 8.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.496 -1.377 . . . . 0.0 109.517 171.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -93.58 -11.88 30.77 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -151.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -48.35 -54.48 13.74 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.26 1.611 0 C-N-CA 123.556 0.742 . . . . 0.0 110.711 172.073 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 122.209 1.004 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -74.99 -26.52 59.62 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.997 2.119 . . . . 0.0 113.468 -171.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -66.55 -49.15 67.39 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 118.988 -2.32 . . . . 0.0 112.911 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 56.4 tp -60.17 -43.7 95.62 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.923 1.689 . . . . 0.0 111.82 179.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -44.14 -52.18 7.48 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -87.99 -28.74 21.24 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.145 -0.972 . . . . 0.0 111.2 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -54.53 -46.46 73.57 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 119.461 1.028 . . . . 0.0 113.581 171.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -89.01 -20.39 24.47 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.476 -1.39 . . . . 0.0 114.352 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.421 ' HB3' ' CD1' ' A' ' 31' ' ' TYR . . . -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.237 -2.164 . . . . 0.0 113.071 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.84 -17.15 64.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.787 171.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.05 -60.07 2.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.467 -1.396 . . . . 0.0 110.032 167.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 35.5 m -62.57 -29.56 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.491 -1.381 . . . . 0.0 113.798 -169.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -82.19 -1.42 49.02 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.765 -1.209 . . . . 0.0 113.608 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -129.42 5.93 5.23 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.985 1.714 . . . . 0.0 112.87 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.2 mt -69.56 159.68 82.65 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 118.421 -2.674 . . . . 0.0 113.168 -175.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.62 -22.05 9.49 Favored 'Trans proline' 0 N--CA 1.434 -2.028 0 C-N-CA 122.82 2.347 . . . . 0.0 111.188 175.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -101.65 81.96 2.22 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 103.512 -2.773 . . . . 0.0 103.512 174.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -64.92 155.88 81.83 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_exo -67.93 153.05 76.31 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 C-N-CA 122.023 1.815 . . . . 0.0 114.872 -163.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -82.15 145.16 30.26 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.4 m -53.41 -51.45 62.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 -166.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -80.32 -12.84 59.56 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.867 -1.77 . . . . 0.0 113.881 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -85.38 -45.95 11.4 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.204 1.001 . . . . 0.0 109.699 171.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -44.28 -38.41 3.84 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.775 2.83 . . . . 0.0 117.407 176.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -49.97 -55.69 13.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 168.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.59 -31.11 36.83 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.924 0.89 . . . . 0.0 112.788 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.52 -31.74 70.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.961 -1.712 . . . . 0.0 112.673 174.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -58.5 -56.94 15.68 Favored 'General case' 0 N--CA 1.431 -1.378 0 O-C-N 120.317 -1.489 . . . . 0.0 110.151 161.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.91 -54.89 13.53 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.25 1.42 . . . . 0.0 113.613 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.07 -37.08 86.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 176.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.421 ' CD1' ' HB3' ' A' ' 9' ' ' ALA . 27.1 t80 -60.99 -53.39 57.86 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.625 1.203 . . . . 0.0 111.066 176.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.417 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.6 mmmt -54.96 -40.75 70.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 127.212 2.205 . . . . 0.0 113.426 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -57.92 -61.08 2.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.784 -1.197 . . . . 0.0 113.112 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.43 -8.3 59.62 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . 0.257 1.3 p -68.19 -55.79 11.04 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.875 2.125 . . . . 0.0 111.722 165.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.5 p -87.23 -69.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 120.435 -1.415 . . . . 0.0 113.153 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.98 9.77 8.68 Favored Glycine 0 N--CA 1.431 -1.697 0 O-C-N 120.699 -1.25 . . . . 0.0 114.927 -173.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -140.27 164.89 28.88 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 169.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -70.84 83.3 0.65 Allowed 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.512 -1.367 . . . . 0.0 111.643 149.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -82.1 -54.53 5.21 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.733 -1.854 . . . . 0.0 114.393 -158.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -84.79 82.32 8.49 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.519 -1.363 . . . . 0.0 114.643 -171.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -81.3 46.5 0.94 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.759 -1.838 . . . . 0.0 114.469 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -160.01 91.0 1.78 Allowed Pre-proline 0 N--CA 1.43 -1.436 0 C-N-CA 126.911 2.084 . . . . 0.0 107.361 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.93 166.95 28.04 Favored 'Trans proline' 0 C--N 1.3 -2.025 0 C-N-CA 122.453 2.102 . . . . 0.0 112.787 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.9 -159.95 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.762 1 N-CA-C 123.346 4.098 . . . . 0.0 123.346 -153.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 20.3 pt -90.57 -43.86 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.05 -1.853 . . . . 0.0 113.271 -156.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -88.39 -24.48 23.06 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.67 1.988 . . . . 0.0 110.741 174.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.41 HD21 ' N ' ' A' ' 48' ' ' ASN 0.401 0.1 OUTLIER 5.79 87.12 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 131.507 3.923 . . . . 0.0 121.161 -173.694 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 60.7 mtt -98.98 -59.74 1.67 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 167.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -84.27 -29.35 26.51 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.302 1.441 . . . . 0.0 113.32 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.28 -23.05 66.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.673 1.989 . . . . 0.0 114.074 -173.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -55.81 -40.15 72.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.873 2.069 . . . . 0.0 113.363 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.5 -33.76 15.82 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.695 1.598 . . . . 0.0 110.947 -174.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.63 -51.9 52.06 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 125.624 1.57 . . . . 0.0 112.717 164.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -31.86 70.65 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.874 -1.142 . . . . 0.0 113.568 -179.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -67.44 -36.13 80.61 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.001 -1.687 . . . . 0.0 112.304 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.7 -28.15 66.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.544 1.137 . . . . 0.0 112.448 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.417 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 10.1 t90 -79.65 -43.67 22.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 126.608 1.963 . . . . 0.0 110.57 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -31.46 63.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.882 2.073 . . . . 0.0 113.802 175.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -52.34 -35.32 50.7 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.694 -1.879 . . . . 0.0 114.198 170.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.6 mp -113.73 31.9 6.2 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.968 0.89 . . . . 0.0 113.368 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -26.15 -50.58 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.463 1 N-CA-C 122.321 4.193 . . . . 0.0 122.321 172.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.29 -17.46 1.98 Allowed Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 119.469 1.032 . . . . 0.0 114.871 -168.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -96.41 -5.07 40.62 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 119.273 1.537 . . . . 0.0 111.459 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.3 p -26.71 -70.48 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 131.103 3.761 . . . . 0.0 117.219 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -53.84 -38.3 64.5 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -166.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -92.35 -21.03 20.48 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.087 1.355 . . . . 0.0 112.931 -177.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.48 -39.07 12.16 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.477 -2.015 . . . . 0.0 110.195 177.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -46.87 -62.03 1.58 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.674 1.989 . . . . 0.0 113.482 173.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.19 -33.99 21.19 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 119.283 3.068 . . . . 0.0 119.283 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -88.55 -28.69 20.59 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.217 1.807 . . . . 0.0 114.422 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -88.44 -26.86 21.89 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.899 -1.751 . . . . 0.0 111.99 174.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.42 ' CE2' HG21 ' A' ' 77' ' ' VAL . 28.0 t80 -66.74 -46.72 74.54 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 120.173 -1.58 . . . . 0.0 112.388 -174.227 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 tt -39.12 -51.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 166.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.21 -26.5 59.01 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -174.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.2 mt -75.96 -53.08 8.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.017 -1.052 . . . . 0.0 110.313 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.42 HG21 ' CE2' ' A' ' 73' ' ' TYR . 41.9 t -68.46 -22.23 26.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.52 1.928 . . . . 0.0 111.168 -171.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.01 -35.25 80.1 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.58 -1.95 . . . . 0.0 113.683 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -83.66 -16.29 45.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.344 1.458 . . . . 0.0 112.666 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -73.23 -65.01 0.86 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.645 -1.285 . . . . 0.0 108.325 163.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.9 mm -57.07 -40.86 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.639 1.976 . . . . 0.0 113.969 -170.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -30.5 66.83 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -86.93 -44.7 11.44 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.043 -1.036 . . . . 0.0 109.07 170.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -94.86 -26.63 16.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -152.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.5 t -40.92 -54.69 2.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.613 1.965 . . . . 0.0 115.88 -175.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.261 1.704 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 166.534 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.402 ' H3 ' ' CD ' ' A' ' 70' ' ' GLU . 84.8 t . . . . . 0 CA--C 1.49 -1.329 0 CA-C-O 122.364 1.078 . . . . 0.0 113.449 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -86.53 0.87 53.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 130.564 3.545 . . . . 0.0 114.819 -174.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -67.4 -56.29 10.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.307 -2.12 . . . . 0.0 111.585 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.501 HD22 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -62.0 -27.95 69.23 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 128.14 2.576 . . . . 0.0 112.558 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.44 ' CZ ' ' HB1' ' A' ' 34' ' ' ALA . 39.7 t80 -56.97 -55.43 34.75 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.564 1.146 . . . . 0.0 110.789 169.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -79.15 -14.09 59.32 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 119.713 -1.867 . . . . 0.0 113.446 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -66.07 -63.08 1.16 Allowed 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.533 1.635 . . . . 0.0 111.09 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -89.4 -17.0 29.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 113.944 -1.48 . . . . 0.0 113.924 -166.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.513 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -71.3 -39.8 71.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 121.095 1.77 . . . . 0.0 112.143 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -40.08 63.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.756 2.022 . . . . 0.0 112.615 170.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.7 -56.64 5.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.614 1.165 . . . . 0.0 110.844 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.4 m -62.71 -27.22 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.263 -1.523 . . . . 0.0 114.347 -174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -69.94 -22.09 63.21 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.59 18.4 4.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.053 -1.029 . . . . 0.0 113.122 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 tp -71.76 156.62 90.94 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 120.12 -1.612 . . . . 0.0 109.614 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.03 -20.58 14.77 Favored 'Trans proline' 0 C--N 1.299 -2.047 0 CA-C-N 123.356 2.234 . . . . 0.0 111.1 -174.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 50.8 m -106.03 76.49 1.17 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -62.09 150.62 83.25 Favored Pre-proline 0 N--CA 1.43 -1.445 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -172.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -66.3 150.8 84.48 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 C-N-CA 123.512 2.808 . . . . 0.0 113.187 -163.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -82.78 171.03 14.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 120.401 1.455 . . . . 0.0 113.944 -171.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.4 m -47.82 -57.9 5.04 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 129.999 3.32 . . . . 0.0 117.039 -168.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -83.77 -22.81 31.77 Favored 'General case' 0 CA--C 1.489 -1.376 0 O-C-N 120.784 -1.197 . . . . 0.0 112.449 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -69.76 -40.77 75.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.401 1.481 . . . . 0.0 110.491 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.2 -53.22 5.2 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.283 3.033 . . . . 0.0 114.575 175.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.03 -46.92 72.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.267 2.227 . . . . 0.0 115.248 176.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.03 -44.27 76.84 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.516 -1.365 . . . . 0.0 111.918 172.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -62.9 -45.37 92.82 Favored 'General case' 0 N--CA 1.431 -1.38 0 C-N-CA 127.406 2.283 . . . . 0.0 113.59 -174.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -59.32 -57.12 14.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.832 2.053 . . . . 0.0 110.575 167.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.86 -46.74 71.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.297 1.039 . . . . 0.0 113.742 -172.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -72.95 -39.82 65.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.513 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 17.4 t80 -57.62 -55.13 38.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.783 1.278 . . . . 0.0 110.839 176.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -60.14 -31.48 70.12 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.216 -1.553 . . . . 0.0 113.654 172.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -57.99 -61.64 2.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.05 -1.656 . . . . 0.0 115.349 174.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.44 ' HB1' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.48 -9.83 48.61 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 119.184 -1.007 . . . . 0.0 112.771 -174.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 97.2 m -71.42 -52.38 18.87 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.715 -1.241 . . . . 0.0 111.211 168.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.0 t -84.94 -54.06 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 120.178 -1.576 . . . . 0.0 111.34 -178.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.32 8.86 Favored Glycine 0 N--CA 1.429 -1.802 0 O-C-N 121.016 -1.052 . . . . 0.0 115.162 168.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -135.37 175.62 9.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 104.267 -2.494 . . . . 0.0 104.267 166.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -66.36 97.79 0.43 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.692 -1.255 . . . . 0.0 113.377 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -85.32 -65.71 0.98 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 119.666 -1.896 . . . . 0.0 114.42 -166.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -85.19 81.86 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.214 -1.554 . . . . 0.0 115.108 -164.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -78.76 48.31 0.81 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 123.874 1.797 . . . . 0.0 113.3 -174.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.8 pttt -160.22 87.35 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.439 0 C-N-CA 128.198 2.599 . . . . 0.0 110.037 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.35 -177.74 3.21 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 123.283 2.656 . . . . 0.0 111.598 164.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -74.46 -175.11 33.38 Favored Glycine 0 N--CA 1.429 -1.785 0 CA-C-N 120.836 1.653 . . . . 0.0 117.041 -161.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.0 pt -94.4 -34.85 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.906 -1.349 . . . . 0.0 110.196 -163.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -117.18 5.07 12.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.692 1.197 . . . . 0.0 109.839 169.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -81.04 103.6 10.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -163.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.1 mtm -73.96 -40.28 63.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.69 -1.256 . . . . 0.0 111.502 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -68.11 -50.83 52.4 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.984 1.314 . . . . 0.0 113.543 -175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -60.73 -35.33 76.09 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.674 -1.266 . . . . 0.0 113.745 175.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -57.6 -44.66 85.61 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.304 -1.497 . . . . 0.0 114.789 171.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -64.39 -49.68 70.66 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.513 -1.367 . . . . 0.0 112.092 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -56.17 -43.4 78.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.024 1.33 . . . . 0.0 114.077 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.29 -36.84 79.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -71.85 -27.19 62.72 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.742 -1.849 . . . . 0.0 112.26 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.03 -24.49 61.56 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.93 -1.731 . . . . 0.0 113.563 170.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 13.4 t90 -81.48 -47.87 12.59 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.208 1.803 . . . . 0.0 110.586 179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.54 -10.28 50.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.196 1.799 . . . . 0.0 114.948 -178.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.5 -40.57 97.16 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.182 -0.949 . . . . 0.0 111.919 164.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.8 mp -108.69 41.11 1.65 Allowed 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 123.922 1.82 . . . . 0.0 110.292 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.03 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.51 1 N-CA-C 122.117 4.117 . . . . 0.0 122.117 166.281 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.87 -18.41 0.86 Allowed Glycine 0 N--CA 1.43 -1.711 0 CA-C-N 120.351 1.432 . . . . 0.0 114.23 -158.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -107.74 26.13 10.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 124.552 2.12 . . . . 0.0 111.162 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.9 m -55.13 -50.7 68.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 129.259 3.024 . . . . 0.0 115.59 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.11 -10.88 59.83 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.999 -1.688 . . . . 0.0 114.458 -175.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -91.14 -45.24 8.78 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 123.367 0.667 . . . . 0.0 110.63 172.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -92.69 -35.37 13.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.95 -61.98 1.96 Allowed 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 121.061 -1.024 . . . . 0.0 112.882 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' CD ' ' H3 ' ' A' ' 1' ' ' VAL . 3.9 pt-20 -40.68 -40.52 1.31 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 119.662 3.208 . . . . 0.0 119.662 176.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -87.38 -36.2 17.91 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.638 -1.914 . . . . 0.0 114.227 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -82.5 -21.8 35.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.495 -1.378 . . . . 0.0 110.853 175.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -63.9 -52.36 60.28 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.853 -1.154 . . . . 0.0 113.98 -177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -39.88 -50.25 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 169.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.91 -15.3 60.21 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.3 mt -75.09 -59.27 2.81 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 120.052 -1.655 . . . . 0.0 110.317 164.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 22.6 t -73.27 -28.99 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 127.25 2.22 . . . . 0.0 111.601 -164.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.99 -37.59 87.98 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.853 -1.779 . . . . 0.0 112.301 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -82.62 -12.67 57.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.787 1.235 . . . . 0.0 112.805 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.98 -61.75 1.74 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.121 1.368 . . . . 0.0 108.919 162.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.7 mm -53.87 -38.94 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 128.705 2.802 . . . . 0.0 114.288 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -48.77 -43.55 37.97 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.093 1.357 . . . . 0.0 114.082 171.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -86.56 -39.5 16.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.074 -1.016 . . . . 0.0 110.353 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -100.6 -20.38 15.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -155.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.6 t -43.05 -55.08 4.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.709 1.604 . . . . 0.0 115.125 177.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.261 1.672 0 O-C-N 121.595 -0.691 . . . . 0.0 109.439 168.807 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 CA--C 1.49 -1.334 0 CA-C-O 122.199 1.0 . . . . 0.0 112.903 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -71.09 -19.06 62.51 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.144 -2.222 . . . . 0.0 114.296 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.9 -34.93 69.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.477 -2.014 . . . . 0.0 112.393 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 tp -62.95 -46.5 87.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.703 1.601 . . . . 0.0 111.651 173.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.479 ' CZ ' ' HB2' ' A' ' 34' ' ' ALA . 8.9 t80 -48.09 -48.14 33.8 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.198 1.799 . . . . 0.0 111.451 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -76.16 -38.24 56.91 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 112.168 -175.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.52 -51.44 62.83 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.59 1.556 . . . . 0.0 113.21 173.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -86.5 -25.31 25.18 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.525 -1.36 . . . . 0.0 114.629 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -62.73 -47.13 84.9 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 121.603 2.001 . . . . 0.0 113.619 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -64.99 -19.6 66.08 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.251 1.42 . . . . 0.0 114.548 174.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.78 -59.05 2.91 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.749 -1.219 . . . . 0.0 110.633 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.6 m -63.22 -28.56 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.69 1.596 . . . . 0.0 113.062 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -70.11 -19.69 63.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -134.64 30.76 3.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 CA-C-N 120.12 1.327 . . . . 0.0 112.322 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.12 155.91 91.02 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 119.613 -1.929 . . . . 0.0 112.067 173.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.72 -19.53 14.31 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 C-N-CA 123.538 2.826 . . . . 0.0 111.633 -172.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.1 m -109.81 76.09 0.97 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -55.7 156.82 8.52 Favored Pre-proline 0 N--CA 1.43 -1.447 0 C-N-CA 127.264 2.225 . . . . 0.0 116.455 -169.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -56.4 136.62 76.6 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 124.095 3.197 . . . . 0.0 115.895 -172.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.9 m -79.44 139.05 37.79 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.658 1.183 . . . . 0.0 111.556 -176.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.9 m -44.4 -47.97 9.81 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.37 2.668 . . . . 0.0 117.907 -167.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -83.55 -27.39 29.34 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.552 -1.343 . . . . 0.0 114.27 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.69 -35.07 58.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.653 1.581 . . . . 0.0 110.581 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -52.05 -35.33 46.97 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 129.202 3.001 . . . . 0.0 113.524 173.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.8 mt -64.03 -47.16 81.33 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.699 1.6 . . . . 0.0 114.298 176.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.17 -45.12 89.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 122.599 1.19 . . . . 0.0 112.458 173.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.84 -45.19 93.2 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.585 2.354 . . . . 0.0 112.606 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -48.59 -56.96 6.98 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.777 2.431 . . . . 0.0 112.318 168.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.3 -48.16 62.39 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 0.0 114.1 -175.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -77.13 -39.5 49.06 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -178.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.481 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 18.9 t80 -58.19 -56.64 19.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.767 1.627 . . . . 0.0 111.748 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -60.32 -35.94 76.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.331 -1.48 . . . . 0.0 112.779 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.424 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 2.6 mt-30 -50.39 -62.2 1.73 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 174.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.06 -9.92 49.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 120.568 1.531 . . . . 0.0 113.042 -178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.7 m -60.93 -67.83 0.37 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 0.0 112.918 167.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . 0.265 11.8 m -87.78 -32.6 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.123 -1.611 . . . . 0.0 114.53 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.03 -37.25 3.71 Favored Glycine 0 N--CA 1.431 -1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 115.984 171.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -118.43 171.24 8.29 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 118.992 1.396 . . . . 0.0 108.279 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -66.44 87.76 0.12 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.149 -1.595 . . . . 0.0 113.278 155.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -80.68 -59.09 2.81 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.374 -2.079 . . . . 0.0 114.994 -161.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.06 83.45 7.76 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.029 -1.67 . . . . 0.0 113.087 -171.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -72.45 42.68 0.1 Allowed 'General case' 0 N--CA 1.431 -1.421 0 CA-C-O 124.266 1.984 . . . . 0.0 114.001 178.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -160.02 84.89 2.1 Favored Pre-proline 0 N--CA 1.43 -1.457 0 C-N-CA 127.168 2.187 . . . . 0.0 108.597 174.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.06 165.76 31.36 Favored 'Trans proline' 0 N--CA 1.434 -1.996 0 C-N-CA 122.586 2.191 . . . . 0.0 109.146 151.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.56 -162.92 18.69 Favored Glycine 0 N--CA 1.431 -1.684 0 CA-C-N 120.802 1.637 . . . . 0.0 115.699 -174.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.4 pt -99.31 -54.1 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 120.632 -1.51 . . . . 0.0 111.72 -162.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.96 7.25 41.17 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 126.921 2.088 . . . . 0.0 110.581 172.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -80.34 73.15 7.23 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.447 1.899 . . . . 0.0 113.837 -169.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.0 mmt -54.67 -48.26 72.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.141 1.776 . . . . 0.0 114.368 -177.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -58.91 -47.51 84.74 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.431 1.092 . . . . 0.0 113.24 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -66.56 -37.36 84.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.955 -1.091 . . . . 0.0 113.521 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -56.24 -41.01 75.04 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.564 -1.335 . . . . 0.0 114.44 171.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.47 -45.99 50.85 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.692 -1.255 . . . . 0.0 113.244 175.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -55.78 -50.63 69.94 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.931 1.292 . . . . 0.0 114.069 175.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 -29.32 65.05 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 113.241 -177.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.93 -38.12 69.9 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.831 -1.793 . . . . 0.0 112.568 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.83 -24.75 66.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.896 -1.128 . . . . 0.0 112.369 175.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.424 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 11.2 t90 -82.17 -46.27 14.0 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.279 1.831 . . . . 0.0 110.86 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -57.24 -24.13 52.66 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.65 2.38 . . . . 0.0 113.764 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -50.4 -41.64 52.42 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.422 -2.049 . . . . 0.0 112.78 168.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mp -116.96 42.77 2.43 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-O 123.534 1.635 . . . . 0.0 112.189 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -43.82 -41.54 5.09 Favored 'General case' 0 N--CA 1.431 -1.414 1 N-CA-C 122.263 4.171 . . . . 0.0 122.263 172.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -114.64 -40.77 0.9 Allowed Glycine 0 N--CA 1.431 -1.658 0 C-N-CA 123.652 0.644 . . . . 0.0 112.648 -169.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -110.87 72.56 0.79 Allowed 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 124.999 2.333 . . . . 0.0 108.144 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 12.5 t -86.81 -65.29 1.03 Allowed 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 111.124 -2.762 . . . . 0.0 111.427 178.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -74.6 -10.8 59.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -151.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -92.9 -26.5 17.59 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.029 2.132 . . . . 0.0 113.922 170.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.37 -47.85 6.69 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.926 -1.733 . . . . 0.0 110.851 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.1 -59.58 1.99 Allowed 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.322 2.649 . . . . 0.0 113.682 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -40.85 -48.39 3.08 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.802 2.89 . . . . 0.0 118.802 168.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -88.41 -29.5 20.18 Favored 'General case' 0 N--CA 1.429 -1.52 0 O-C-N 119.607 -1.933 . . . . 0.0 112.531 -173.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.92 -29.97 64.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.574 -1.328 . . . . 0.0 111.862 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -70.85 -53.68 14.35 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.935 1.294 . . . . 0.0 113.512 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.99 -50.15 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.33 -36.67 68.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -175.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 pp -75.12 -46.16 36.28 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.22 -0.925 . . . . 0.0 112.607 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 t -62.19 -30.08 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.238 1.815 . . . . 0.0 111.347 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -58.75 -42.18 88.25 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.882 -1.761 . . . . 0.0 112.715 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -74.84 -27.78 60.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.683 1.193 . . . . 0.0 113.077 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.7 mt -68.58 -52.3 33.13 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.321 1.448 . . . . 0.0 110.298 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.67 -32.29 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 119.939 -1.725 . . . . 0.0 113.512 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.8 -32.47 65.72 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.176 -1.577 . . . . 0.0 114.765 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -87.41 -38.94 15.69 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.776 -1.202 . . . . 0.0 111.891 171.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -95.58 -7.36 38.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 -163.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.0 t -54.26 -60.42 3.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.188 -1.57 . . . . 0.0 113.372 166.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.259 1.564 0 C-N-CA 124.249 1.02 . . . . 0.0 108.979 168.688 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 123.044 1.402 . . . . 0.0 114.016 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -63.74 -29.77 70.95 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.045 2.538 . . . . 0.0 112.622 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -59.65 -43.52 93.86 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.784 -2.447 . . . . 0.0 115.474 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 41.8 tp -64.42 -42.71 95.9 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.463 -1.398 . . . . 0.0 111.09 176.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.416 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -51.02 -38.6 52.37 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.39 1.876 . . . . 0.0 111.367 176.667 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.43 -47.82 38.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.042 -1.036 . . . . 0.0 112.606 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -54.96 -41.44 71.13 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.949 1.7 . . . . 0.0 112.868 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -76.99 -45.34 27.71 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.661 1.184 . . . . 0.0 113.76 173.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.95 -41.23 74.81 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.103 -2.248 . . . . 0.0 114.839 -167.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -65.97 -15.74 63.27 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.671 1.188 . . . . 0.0 113.259 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.5 -56.69 4.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.712 1.205 . . . . 0.0 111.755 163.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 6.9 m -63.08 -24.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 119.745 -1.847 . . . . 0.0 113.597 -170.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -70.14 -18.76 63.23 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -123.9 9.29 8.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -177.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -63.15 146.72 95.66 Favored Pre-proline 0 N--CA 1.431 -1.416 0 O-C-N 120.62 -1.3 . . . . 0.0 113.301 -171.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.77 -20.57 15.26 Favored 'Trans proline' 0 N--CA 1.434 -1.994 0 C-N-CA 123.506 2.804 . . . . 0.0 111.312 -168.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 53.7 m -113.41 75.27 0.91 Allowed 'General case' 0 N--CA 1.43 -1.472 1 N-CA-C 99.609 -4.219 . . . . 0.0 99.609 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.75 156.92 11.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -164.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -59.68 134.52 58.12 Favored 'Trans proline' 0 N--CA 1.434 -1.992 0 C-N-CA 123.621 2.881 . . . . 0.0 113.892 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.8 t -80.97 166.4 20.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.729 1.149 . . . . 0.0 112.843 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -51.59 -59.44 4.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 128.237 2.615 . . . . 0.0 117.343 -163.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -70.61 -26.97 63.74 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.913 -1.117 . . . . 0.0 112.548 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.87 -41.3 37.28 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.501 -1.374 . . . . 0.0 111.716 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.1 tp -46.64 -46.37 19.77 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 128.928 2.891 . . . . 0.0 115.544 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.3 mt -48.04 -55.98 8.84 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.503 1.921 . . . . 0.0 114.922 170.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -72.95 -38.37 66.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.521 1.128 . . . . 0.0 112.178 -177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 6.7 mp -66.85 -36.06 81.47 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 177.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.31 -57.96 10.57 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.343 1.457 . . . . 0.0 110.764 165.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.59 -52.97 26.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.183 1.393 . . . . 0.0 113.597 -173.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.21 -40.55 86.45 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.478 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 29.1 t80 -57.06 -52.94 63.27 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.735 1.255 . . . . 0.0 110.933 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.427 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.2 mmmt -57.81 -38.6 75.84 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.005 -2.309 . . . . 0.0 113.346 172.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -56.1 -57.71 11.03 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -89.44 -10.56 45.98 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 112.881 -175.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -64.48 -59.51 4.24 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.505 -1.372 . . . . 0.0 110.665 167.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.5 -60.97 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 O-C-N 120.821 -1.174 . . . . 0.0 112.784 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.79 -25.65 6.43 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 124.439 1.019 . . . . 0.0 113.544 -177.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -120.29 -177.85 3.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -66.9 124.7 23.7 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 118.768 -2.458 . . . . 0.0 112.915 147.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.09 -59.74 2.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.222 -1.549 . . . . 0.0 109.97 176.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mtmm -80.19 161.4 25.24 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.46 1.504 . . . . 0.0 109.132 174.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HA ' ' CZ2' ' A' ' 55' ' ' TRP . 21.8 tt0 -141.98 20.27 2.12 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.029 1.871 . . . . 0.0 109.733 168.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.1 tttp -129.53 91.53 40.71 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.198 -1.564 . . . . 0.0 110.644 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -77.94 159.37 30.86 Favored 'Trans proline' 0 C--N 1.299 -2.051 0 C-N-CA 121.716 1.611 . . . . 0.0 108.534 146.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.32 -145.89 2.28 Favored Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 117.472 1.749 . . . . 0.0 117.472 -171.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.511 HG13 ' H ' ' A' ' 47' ' ' PHE . 5.0 pt -107.11 -75.1 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.479 -1.012 . . . . 0.0 109.514 -168.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.511 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -73.18 -5.63 40.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.145 1.778 . . . . 0.0 113.04 169.215 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -72.52 67.64 0.76 Allowed 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 127.121 2.169 . . . . 0.0 112.126 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.6 ptm -64.7 -32.35 73.98 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.816 1.646 . . . . 0.0 112.525 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -64.54 -47.55 78.39 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.481 -0.762 . . . . 0.0 112.419 175.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.06 -42.25 85.07 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.996 1.318 . . . . 0.0 112.288 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -53.71 -48.49 69.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -63.24 -48.31 78.77 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.712 -1.243 . . . . 0.0 112.749 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.61 -51.36 49.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 126.926 2.091 . . . . 0.0 113.706 176.063 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . 0.447 ' CZ2' ' HA ' ' A' ' 42' ' ' GLU . 17.9 t90 -73.18 -33.93 65.7 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.918 1.687 . . . . 0.0 112.715 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.13 -34.41 76.3 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.742 -1.849 . . . . 0.0 111.837 177.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.91 65.3 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.985 -1.072 . . . . 0.0 113.118 173.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.427 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 13.9 t90 -81.8 -51.23 8.35 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.599 1.56 . . . . 0.0 110.131 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -46.31 -38.55 8.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.938 3.295 . . . . 0.0 113.634 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -54.69 -33.25 60.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.357 -1.464 . . . . 0.0 114.437 176.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mp -117.02 24.56 11.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -63.16 3.53 0.26 Allowed 'General case' 0 N--CA 1.43 -1.439 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -173.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 -28.17 0.23 Allowed Glycine 0 N--CA 1.429 -1.775 0 CA-C-N 121.801 2.091 . . . . 0.0 111.518 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -88.42 -28.16 21.08 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.594 -1.533 . . . . 0.0 113.907 -167.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -87.47 15.6 6.42 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 -152.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -11.61 60.42 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 116.982 -3.573 . . . . 0.0 114.148 166.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -93.09 -38.06 11.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.243 2.217 . . . . 0.0 113.49 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -93.18 -49.24 6.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.028 -1.045 . . . . 0.0 113.344 -175.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.5 -61.61 1.17 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.576 1.95 . . . . 0.0 114.253 176.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -42.36 -35.67 1.07 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 119.64 3.2 . . . . 0.0 119.64 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtm -88.08 -41.05 13.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.065 -2.272 . . . . 0.0 112.248 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -76.52 -22.78 53.95 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.421 -1.424 . . . . 0.0 111.653 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.5 -58.95 4.56 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 124.854 1.262 . . . . 0.0 113.23 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.98 -49.03 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.737 1.615 . . . . 0.0 115.345 172.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.0 69.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.62 -57.85 10.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.3 1.04 . . . . 0.0 111.298 173.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 77.5 t -72.48 -20.05 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 125.319 1.447 . . . . 0.0 111.35 -171.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.62 -49.99 66.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 118.637 -2.54 . . . . 0.0 112.309 169.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -69.99 -27.2 64.51 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.852 1.661 . . . . 0.0 111.928 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.356 9.3 mp -81.87 -45.46 15.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.374 2.269 . . . . 0.0 111.053 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.19 -32.41 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 119.414 -2.054 . . . . 0.0 113.269 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.21 -29.37 31.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 170.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.24 -47.26 8.99 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.691 1.196 . . . . 0.0 112.485 166.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -90.52 -11.18 40.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -159.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -43.7 -54.3 5.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.358 2.263 . . . . 0.0 116.355 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.259 1.593 0 O-C-N 121.139 -0.976 . . . . 0.0 110.418 -176.543 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.452 HG11 ' H ' ' A' ' 4' ' ' LEU . 5.2 t . . . . . 0 CA--C 1.49 -1.365 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.0 p -67.92 -27.96 67.08 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 128.343 2.657 . . . . 0.0 114.469 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -64.62 -47.76 77.41 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.756 -1.215 . . . . 0.0 113.708 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.452 ' H ' HG11 ' A' ' 1' ' ' VAL . 64.3 tp -57.52 -48.84 78.2 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.085 2.154 . . . . 0.0 110.833 178.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 1.8 t80 -45.59 -43.89 12.5 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.667 2.387 . . . . 0.0 111.904 174.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -78.52 -32.45 48.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.518 -1.364 . . . . 0.0 114.216 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.45 -51.81 67.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 123.678 1.704 . . . . 0.0 110.934 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -88.96 -22.64 22.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.622 -168.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.423 ' HB2' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -47.0 73.03 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.307 2.003 . . . . 0.0 113.515 175.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -65.07 -20.46 66.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.077 1.751 . . . . 0.0 113.218 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.17 -58.06 3.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 123.926 0.89 . . . . 0.0 110.493 167.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.4 m -64.22 -27.61 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 O-C-N 119.96 -1.713 . . . . 0.0 113.974 -171.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.84 -18.72 62.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.42 7.52 6.4 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.039 1.336 . . . . 0.0 113.541 -172.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.5 tp -68.8 153.6 95.77 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.855 -1.778 . . . . 0.0 110.73 -175.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -75.27 -17.52 18.9 Favored 'Trans proline' 0 C--N 1.301 -1.953 0 C-N-CA 122.948 2.432 . . . . 0.0 111.708 -169.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 85.1 m -107.28 78.27 1.21 Allowed 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.135 -3.283 . . . . 0.0 102.135 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -57.76 151.58 41.49 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -176.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -65.0 148.94 89.95 Favored 'Trans proline' 0 C--N 1.3 -1.993 0 C-N-CA 122.753 2.302 . . . . 0.0 114.949 -164.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.3 t -82.12 160.67 23.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.526 -1.358 . . . . 0.0 112.067 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.1 m -47.99 -59.87 3.04 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.126 2.57 . . . . 0.0 117.924 -162.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.91 -12.86 59.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.827 1.251 . . . . 0.0 113.403 -175.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -89.38 -43.89 10.58 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.574 1.95 . . . . 0.0 108.788 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.7 tt -53.28 -37.66 62.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.821 2.848 . . . . 0.0 114.556 171.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -40.01 63.18 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.761 -1.212 . . . . 0.0 112.934 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.44 -40.47 85.43 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.977 -1.702 . . . . 0.0 111.166 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 26.1 mt -56.05 -48.25 76.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.495 1.518 . . . . 0.0 114.021 166.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -55.01 -55.25 32.97 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.503 1.521 . . . . 0.0 111.99 173.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.5 -50.77 67.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 119.582 1.083 . . . . 0.0 112.931 -176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 mp -70.5 -38.87 74.38 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 176.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.423 ' CD1' ' HB2' ' A' ' 9' ' ' ALA . 38.2 t80 -55.62 -58.41 7.9 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.223 1.009 . . . . 0.0 109.831 173.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -58.32 -35.81 72.43 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.948 -1.72 . . . . 0.0 113.689 176.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.46 -58.47 7.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 119.338 0.972 . . . . 0.0 113.121 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.407 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -84.4 -15.34 46.65 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.098 -1.626 . . . . 0.0 113.379 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.7 m -67.65 -62.42 1.42 Allowed 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.971 -1.08 . . . . 0.0 113.61 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.4 p -87.25 -38.87 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.957 -1.714 . . . . 0.0 112.24 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.79 -42.34 1.74 Allowed Glycine 0 N--CA 1.429 -1.801 0 O-C-N 120.779 -1.2 . . . . 0.0 113.278 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -128.82 171.94 11.78 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -169.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.4 p-10 -60.54 124.53 20.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.1 -1.625 . . . . 0.0 113.786 158.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -103.08 -86.17 0.44 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 121.137 -0.977 . . . . 0.0 111.14 -175.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -84.67 81.93 8.64 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.639 -1.288 . . . . 0.0 113.843 -164.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -76.63 45.42 0.4 Allowed 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 125.117 2.389 . . . . 0.0 113.573 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.22 81.01 2.35 Favored Pre-proline 0 N--CA 1.43 -1.47 0 C-N-CA 126.558 1.943 . . . . 0.0 107.852 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.71 152.4 69.54 Favored 'Trans proline' 0 C--N 1.299 -2.057 0 C-N-CA 122.473 2.116 . . . . 0.0 109.634 165.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -123.72 0.24 Allowed Glycine 0 N--CA 1.431 -1.694 0 N-CA-C 119.425 2.53 . . . . 0.0 119.425 -160.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.426 HG13 ' H ' ' A' ' 47' ' ' PHE . 2.4 pt -116.89 -68.85 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 124.56 1.144 . . . . 0.0 111.698 -163.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.426 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -80.53 6.39 12.58 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.785 2.034 . . . . 0.0 112.073 169.706 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.469 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 24.8 m120 -81.39 60.28 4.38 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 128.073 2.549 . . . . 0.0 113.022 -174.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 49.5 tpp -69.35 -36.3 76.73 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.333 1.453 . . . . 0.0 113.063 -175.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -74.06 -40.84 62.52 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.912 -1.118 . . . . 0.0 110.557 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.469 ' HB2' ' HB3' ' A' ' 48' ' ' ASN . 5.2 m-20 -61.78 -38.99 90.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.631 1.172 . . . . 0.0 114.154 176.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -49.64 -39.42 35.99 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 170.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -77.98 -48.64 15.76 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.715 -1.241 . . . . 0.0 112.923 173.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -59.35 -42.38 91.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -177.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -67.22 -32.46 73.52 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.448 1.099 . . . . 0.0 111.439 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -73.68 -31.17 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.059 -1.651 . . . . 0.0 112.754 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.18 62.21 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.429 -1.419 . . . . 0.0 113.39 170.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -87.39 -47.49 8.74 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.262 -1.524 . . . . 0.0 110.55 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.77 -7.17 14.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.711 -1.868 . . . . 0.0 114.785 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.83 -37.74 71.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.623 -1.923 . . . . 0.0 112.066 162.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.4 mp -116.93 30.96 7.03 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 126.2 1.8 . . . . 0.0 113.1 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -50.07 -33.21 17.67 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 120.628 3.566 . . . . 0.0 120.628 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.24 -47.22 2.06 Favored Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -159.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -115.38 -35.73 4.53 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-O 122.164 0.983 . . . . 0.0 112.397 -164.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.24 39.36 0.82 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -136.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -77.94 -39.07 43.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.612 1.565 . . . . 0.0 108.131 163.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -67.92 -33.59 74.99 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.009 2.123 . . . . 0.0 110.581 -179.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.46 -45.01 14.12 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 123.974 0.909 . . . . 0.0 111.652 172.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.97 -60.65 1.54 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -43.3 -43.93 5.19 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 172.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -88.26 -19.82 26.28 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.448 -2.033 . . . . 0.0 115.914 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.31 -28.57 19.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.692 -1.255 . . . . 0.0 110.952 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -64.27 -43.92 93.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.826 -1.171 . . . . 0.0 113.379 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 14.3 tt -39.28 -52.05 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 166.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.55 -22.84 56.7 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.4 mt -69.13 -63.38 1.07 Allowed 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.739 -1.226 . . . . 0.0 109.071 167.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 53.1 t -66.34 -24.77 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 C-N-CA 126.155 1.782 . . . . 0.0 111.087 -166.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.39 -44.81 92.72 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.028 -1.67 . . . . 0.0 114.163 171.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -82.0 -24.38 35.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.932 0.872 . . . . 0.0 111.852 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 65.2 mt -71.44 -50.11 34.94 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.126 1.37 . . . . 0.0 109.487 175.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.7 mt -64.74 -33.48 63.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 O-C-N 119.484 -2.01 . . . . 0.0 112.738 176.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.36 -30.66 65.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.62 -1.925 . . . . 0.0 114.94 172.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -87.25 -38.08 16.64 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.348 1.459 . . . . 0.0 111.392 173.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -106.58 -13.68 15.24 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -158.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 59.9 p -42.35 -54.99 3.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.208 1.003 . . . . 0.0 108.932 172.305 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 CA--C 1.49 -1.351 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 m -75.45 6.87 4.1 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.441 2.696 . . . . 0.0 114.654 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -71.02 -51.49 25.07 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.775 -1.828 . . . . 0.0 111.005 175.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.62 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -68.39 -27.58 66.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.265 1.826 . . . . 0.0 111.785 178.216 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 58.3 t80 -56.69 -50.56 71.77 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 123.911 0.884 . . . . 0.0 110.342 168.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -79.87 -11.99 59.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.092 -1.63 . . . . 0.0 113.729 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -66.09 -57.99 6.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.431 -2.043 . . . . 0.0 111.523 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HB3' HG11 ' A' ' 77' ' ' VAL . 47.9 mttm -81.09 -36.42 30.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.66 -1.609 . . . . 0.0 113.715 -169.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.417 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.89 -39.57 76.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.578 -1.951 . . . . 0.0 114.079 -173.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -65.3 -20.79 66.57 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.593 1.557 . . . . 0.0 113.27 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.28 -50.24 11.22 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.039 -1.038 . . . . 0.0 111.878 171.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 77' ' ' VAL . 30.8 m -66.56 -21.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.024 -1.672 . . . . 0.0 113.473 -175.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 172.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -142.86 25.08 1.81 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.722 -1.236 . . . . 0.0 113.297 -173.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.6 tp -70.24 153.94 94.87 Favored Pre-proline 0 N--CA 1.43 -1.427 0 C-N-CA 125.965 1.706 . . . . 0.0 110.1 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.49 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 85.5 Cg_endo -74.24 -21.22 17.95 Favored 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 124.113 2.505 . . . . 0.0 111.17 -173.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 m -102.46 74.74 1.41 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 104.065 -2.568 . . . . 0.0 104.065 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -58.11 150.78 49.73 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -175.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 140.19 85.45 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 123.087 2.525 . . . . 0.0 115.329 -164.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.1 m -73.61 159.52 32.96 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.825 1.25 . . . . 0.0 113.213 -177.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.8 t -55.69 -47.6 76.49 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 -160.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.26 -21.33 27.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.401 -2.062 . . . . 0.0 112.749 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -72.86 -36.94 67.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.673 1.589 . . . . 0.0 112.334 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 tp -52.13 -40.61 61.6 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.85 2.86 . . . . 0.0 116.22 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . 0.344 1.3 tm? -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.619 1.968 . . . . 0.0 114.434 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -64.26 -47.27 80.22 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.074 0.949 . . . . 0.0 110.303 174.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.66 -37.34 85.99 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -58.35 -57.15 14.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.274 2.306 . . . . 0.0 111.295 167.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.22 -51.42 54.15 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 119.664 1.12 . . . . 0.0 113.716 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 69' ' ' ALA . 4.0 mm? -74.1 -37.61 64.1 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.338 1.606 . . . . 0.0 115.338 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.417 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 49.8 t80 -62.31 -52.98 61.49 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.115 -2.241 . . . . 0.0 111.289 174.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -59.04 -37.96 78.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.038 -2.289 . . . . 0.0 113.285 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . 27.8 mt-30 -48.45 -61.46 2.0 Allowed 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 170.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -84.56 -21.14 30.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.682 -1.261 . . . . 0.0 112.743 -175.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.5 m -62.94 -63.27 1.26 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 113.005 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.51 -27.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.774 -1.204 . . . . 0.0 114.14 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.54 -13.27 67.02 Favored Glycine 0 N--CA 1.431 -1.674 0 O-C-N 120.307 -1.495 . . . . 0.0 116.084 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -144.92 164.08 32.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -53.0 111.5 0.68 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 153.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.96 -75.33 0.63 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.988 1.715 . . . . 0.0 111.619 -166.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 81.38 6.23 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.965 -1.709 . . . . 0.0 112.301 -174.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -79.49 52.42 1.38 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.084 1.421 . . . . 0.0 112.64 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -160.15 84.94 2.06 Favored Pre-proline 0 N--CA 1.43 -1.443 0 O-C-N 120.544 -1.347 . . . . 0.0 107.774 160.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.48 154.99 64.5 Favored 'Trans proline' 0 N--CA 1.434 -2.02 0 C-N-CA 122.295 1.997 . . . . 0.0 108.705 157.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.81 -170.33 32.25 Favored Glycine 0 N--CA 1.43 -1.702 0 N-CA-C 117.049 1.58 . . . . 0.0 117.049 -159.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 11.9 pt -90.58 -48.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.953 -1.322 . . . . 0.0 110.851 -156.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -90.65 1.16 57.05 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.993 2.117 . . . . 0.0 109.523 168.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.51 61.91 6.95 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.472 -1.393 . . . . 0.0 112.803 -166.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.07 72.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.949 1.7 . . . . 0.0 113.709 -177.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -61.95 -54.79 36.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.973 1.709 . . . . 0.0 111.455 173.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -66.92 -38.73 86.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.415 1.486 . . . . 0.0 110.987 -177.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -57.56 -36.55 71.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -71.37 -46.5 60.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.014 -1.679 . . . . 0.0 112.841 173.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -58.79 -45.0 90.87 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.228 1.411 . . . . 0.0 113.023 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -66.51 -31.25 71.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.409 1.483 . . . . 0.0 113.171 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.16 -41.55 73.67 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.297 -1.502 . . . . 0.0 111.277 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.04 -18.13 64.6 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.851 -1.156 . . . . 0.0 113.455 175.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -85.18 -50.61 7.25 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.959 1.704 . . . . 0.0 109.47 176.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -57.69 -22.56 46.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.84 2.856 . . . . 0.0 113.364 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -50.07 -32.46 15.7 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.686 1.594 . . . . 0.0 114.101 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.4 mp -115.84 17.93 15.85 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -31.09 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.42 1 N-CA-C 123.81 4.744 . . . . 0.0 123.81 -176.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -106.85 -40.24 1.88 Allowed Glycine 0 N--CA 1.429 -1.769 0 CA-C-N 120.243 1.383 . . . . 0.0 113.652 -176.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -95.8 -3.37 45.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.911 -1.346 . . . . 0.0 112.471 -172.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 m -26.78 -59.79 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 130.055 3.342 . . . . 0.0 118.68 -174.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.0 -38.99 73.85 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.1 -37.04 47.31 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.037 1.735 . . . . 0.0 111.807 -173.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.15 -37.88 19.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.997 -1.064 . . . . 0.0 110.342 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.634 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -54.12 -62.36 1.71 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 176.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -43.89 -32.63 1.14 Allowed 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 119.545 3.165 . . . . 0.0 119.545 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -88.39 -37.65 15.72 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.837 -2.414 . . . . 0.0 114.15 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -71.74 -27.0 62.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.735 -1.228 . . . . 0.0 111.151 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' HG21 ' A' ' 77' ' ' VAL . 37.0 t80 -73.32 -48.64 32.76 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.742 -0.599 . . . . 0.0 111.668 -159.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.41 ' HB ' HD12 ' A' ' 4' ' ' LEU . 18.5 tt -44.87 -48.16 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 171.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.93 -15.45 60.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.1 mt -76.09 -59.12 2.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.495 -1.378 . . . . 0.0 109.212 167.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG13 HG11 ' A' ' 12' ' ' VAL . 32.5 t -71.28 -27.16 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.515 -1.366 . . . . 0.0 111.779 -166.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.79 -37.21 84.12 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.193 -2.192 . . . . 0.0 114.032 176.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -79.56 -14.84 58.57 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.429 -1.42 . . . . 0.0 113.502 175.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 92.3 mt -81.2 -49.17 11.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.237 2.215 . . . . 0.0 110.358 172.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 68.3 mt -59.94 -31.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 119.181 -2.199 . . . . 0.0 112.695 174.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.13 -31.88 61.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 168.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -86.83 -35.38 19.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.075 -1.641 . . . . 0.0 109.904 174.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -104.38 -17.04 14.94 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.603 1.705 . . . . 0.0 115.603 -156.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.306 10.3 p -46.11 -56.43 5.63 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 116.574 2.065 . . . . 0.0 116.574 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.26 1.657 0 O-C-N 120.877 -1.139 . . . . 0.0 110.445 175.29 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -87.4 9.33 21.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.505 2.722 . . . . 0.0 115.371 -172.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -61.79 -46.88 87.61 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.374 -1.454 . . . . 0.0 110.957 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.606 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -70.97 -34.46 71.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.874 2.47 . . . . 0.0 112.251 175.392 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 14.2 t80 -60.76 -51.94 67.21 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.834 1.254 . . . . 0.0 109.645 178.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -76.63 -21.34 55.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.041 -1.037 . . . . 0.0 111.594 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -53.77 46.26 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.681 -1.262 . . . . 0.0 113.329 166.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' HB3' HG11 ' A' ' 77' ' ' VAL . 39.6 mmtm -86.36 -25.64 25.24 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 119.864 -1.773 . . . . 0.0 114.589 -173.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.503 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.83 -45.45 74.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 124.653 2.168 . . . . 0.0 114.009 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -58.37 -26.81 63.61 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.395 2.278 . . . . 0.0 113.442 170.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.97 -56.57 4.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 123.999 0.919 . . . . 0.0 110.943 171.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 77' ' ' VAL . 25.1 m -63.24 -31.68 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 O-C-N 120.707 -1.245 . . . . 0.0 113.536 -172.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -69.82 -26.6 64.32 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 176.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -107.87 -9.86 15.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.575 1.55 . . . . 0.0 112.851 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.502 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.7 tp -62.01 151.06 81.62 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 127.946 2.498 . . . . 0.0 111.685 -172.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.502 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 88.4 Cg_endo -74.06 -18.34 21.35 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.392 2.061 . . . . 0.0 112.104 -169.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.3 m -106.1 79.18 1.38 Allowed 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 174.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -61.22 154.92 59.64 Favored Pre-proline 0 N--CA 1.431 -1.398 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -171.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -66.69 144.97 74.06 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 C-N-CA 122.698 2.265 . . . . 0.0 113.958 -168.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.7 t -78.38 144.52 35.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.7 m -41.19 -59.79 1.42 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 130.221 3.409 . . . . 0.0 117.417 -167.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -87.8 -13.4 42.33 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.605 -1.309 . . . . 0.0 112.349 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.12 -50.18 9.34 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.059 1.344 . . . . 0.0 110.042 175.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -42.21 -41.03 2.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 129.245 3.018 . . . . 0.0 115.442 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.28 -48.45 80.43 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -58.54 -43.49 89.27 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.648 1.579 . . . . 0.0 114.453 170.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.97 -40.46 96.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.614 1.966 . . . . 0.0 111.71 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -49.82 -49.01 50.46 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 128.268 2.627 . . . . 0.0 112.468 171.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -45.54 65.54 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.765 2.075 . . . . 0.0 114.857 175.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -71.74 -49.37 39.8 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.805 -1.184 . . . . 0.0 113.885 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.503 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.1 t80 -52.66 -52.85 53.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.344 2.257 . . . . 0.0 111.196 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.7 mmmt -62.25 -37.59 86.03 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.516 -1.365 . . . . 0.0 111.784 172.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -57.04 14.65 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.258 . . -89.78 -7.09 55.21 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 113.532 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -68.02 -61.01 2.06 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.976 -1.702 . . . . 0.0 112.635 166.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 m -87.33 -42.87 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.81 -22.87 38.38 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.685 -1.259 . . . . 0.0 114.047 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -125.67 159.89 31.08 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 178.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -55.8 107.69 0.37 Allowed 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 119.976 -1.703 . . . . 0.0 113.518 152.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -78.21 -62.3 1.72 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.989 -1.694 . . . . 0.0 111.179 -173.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.49 168.28 19.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.64 1.176 . . . . 0.0 109.022 169.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -146.08 29.08 1.09 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.956 1.836 . . . . 0.0 106.255 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -142.72 78.95 15.44 Favored Pre-proline 0 N--CA 1.43 -1.444 0 O-C-N 120.833 -1.167 . . . . 0.0 111.044 -168.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -77.41 168.56 22.65 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 C-N-CA 122.699 2.266 . . . . 0.0 110.242 160.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -154.33 6.2 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 120.413 2.925 . . . . 0.0 120.413 -168.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.436 HG13 ' H ' ' A' ' 47' ' ' PHE . 3.2 pt -104.12 -64.72 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 125.321 1.448 . . . . 0.0 110.631 -165.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.8 OUTLIER -84.18 -4.94 59.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.66 1.584 . . . . 0.0 111.392 168.506 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -76.3 69.32 2.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.189 2.195 . . . . 0.0 113.851 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 48.9 mtm -61.96 -39.7 93.02 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.22 1.408 . . . . 0.0 113.29 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -41.66 93.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 174.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.31 -49.41 64.27 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.429 -1.419 . . . . 0.0 111.606 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm-85 -45.5 -60.18 2.31 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.37 1.868 . . . . 0.0 115.533 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -72.92 -38.37 66.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 122.218 1.009 . . . . 0.0 112.687 -176.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -85.88 -13.64 47.28 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.242 -2.161 . . . . 0.0 113.563 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -68.75 -36.75 78.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.406 -1.434 . . . . 0.0 110.935 158.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -69.98 -26.36 64.06 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.465 -2.022 . . . . 0.0 112.551 175.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.89 -25.03 64.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.792 -1.192 . . . . 0.0 113.229 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.449 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 19.2 t90 -81.62 -46.72 13.99 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 125.311 1.444 . . . . 0.0 110.302 174.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -53.82 -30.35 44.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 128.894 2.878 . . . . 0.0 115.089 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -51.72 -31.87 28.06 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.618 -1.926 . . . . 0.0 113.45 167.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 mt -105.12 -1.93 24.92 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.355 1.462 . . . . 0.0 114.261 -173.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -29.74 -26.43 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.419 2 N-CA-C 124.78 5.104 . . . . 0.0 124.78 -161.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.13 31.54 0.4 Allowed Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 121.901 2.137 . . . . 0.0 110.878 170.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -117.36 -51.33 2.52 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 123.21 1.481 . . . . 0.0 110.448 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.0 m -86.44 35.71 0.67 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -162.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -66.28 -10.21 40.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.21 -1.556 . . . . 0.0 112.783 150.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -87.22 -35.03 18.77 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.699 2.799 . . . . 0.0 112.601 171.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -94.02 -53.92 3.79 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.366 -1.458 . . . . 0.0 114.905 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -43.51 -52.21 6.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.135 2.174 . . . . 0.0 113.779 -174.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -41.41 -48.71 3.82 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.76 2.874 . . . . 0.0 118.76 170.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.07 -37.52 15.06 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.689 2.796 . . . . 0.0 112.484 -170.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -77.19 -28.27 53.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.601 -1.312 . . . . 0.0 112.139 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 77' ' ' VAL . 32.9 t80 -62.58 -50.08 72.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.243 1.017 . . . . 0.0 113.654 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.438 ' HB ' HD12 ' A' ' 4' ' ' LEU . 18.8 tt -52.75 -42.48 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 177.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.38 -17.27 61.3 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.022 -1.674 . . . . 0.0 115.167 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.19 -53.94 6.79 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.455 -1.403 . . . . 0.0 110.265 167.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 12' ' ' VAL . 13.3 t -68.61 -25.79 31.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.105 2.162 . . . . 0.0 112.069 -169.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.55 -34.84 78.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.516 -1.99 . . . . 0.0 113.077 172.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -75.28 -29.7 60.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.387 1.475 . . . . 0.0 111.959 177.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.59 -51.86 25.48 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 126.583 1.953 . . . . 0.0 110.09 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.9 mt -62.16 -33.67 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 O-C-N 120.014 -1.678 . . . . 0.0 112.973 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.73 -22.29 61.85 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 169.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -87.12 -46.72 9.51 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.697 -1.877 . . . . 0.0 109.339 165.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -98.1 -15.98 19.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 -150.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.0 t -49.3 -54.89 14.75 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.627 1.558 . . . . 0.0 114.865 173.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.261 1.679 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 168.253 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.491 -1.32 0 CA-C-O 122.888 1.328 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.0 p -64.87 -41.17 95.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 128.86 2.864 . . . . 0.0 114.612 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -70.19 -37.25 75.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.881 -1.762 . . . . 0.0 112.498 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.78 -43.97 87.21 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.802 1.241 . . . . 0.0 110.939 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.7 OUTLIER -47.96 -46.06 31.92 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.911 1.684 . . . . 0.0 111.665 173.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -77.1 -36.23 55.77 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.883 -1.135 . . . . 0.0 112.833 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -60.57 -51.91 67.42 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.734 1.214 . . . . 0.0 112.376 174.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -84.83 -23.52 29.03 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.458 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.24 -46.96 72.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.235 -2.166 . . . . 0.0 113.47 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -68.36 -15.79 63.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 113.661 -1.609 . . . . 0.0 113.47 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.88 -63.93 1.03 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 121.093 -1.005 . . . . 0.0 109.58 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.403 HG11 HG13 ' A' ' 77' ' ' VAL . 34.8 m -63.09 -31.52 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.323 -1.486 . . . . 0.0 114.161 -166.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.59 -14.21 61.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.964 -1.085 . . . . 0.0 113.79 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -137.46 27.14 2.82 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.547 1.139 . . . . 0.0 112.47 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.441 HD11 HD13 ' A' ' 81' ' ' ILE . 8.1 mt -72.21 164.38 59.74 Favored Pre-proline 0 N--CA 1.43 -1.433 0 O-C-N 120.072 -1.642 . . . . 0.0 110.734 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.62 -29.92 15.47 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.035 2.477 . . . . 0.0 111.184 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 87.6 m -102.4 77.96 1.69 Allowed 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -58.78 152.15 49.51 Favored Pre-proline 0 N--CA 1.431 -1.387 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -67.46 137.83 44.2 Favored 'Trans proline' 0 C--N 1.3 -1.977 0 C-N-CA 122.743 2.295 . . . . 0.0 113.015 -162.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.8 t -70.4 160.57 32.09 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 119.806 1.185 . . . . 0.0 113.126 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.4 m -54.26 -53.78 49.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -158.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -79.29 -16.59 56.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.793 -1.192 . . . . 0.0 113.023 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -83.82 -45.24 13.5 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.669 1.588 . . . . 0.0 109.605 -178.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -48.13 -34.02 9.2 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.934 2.894 . . . . 0.0 115.567 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -39.67 65.55 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.204 -1.56 . . . . 0.0 113.81 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -72.65 -38.49 67.65 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.496 -1.378 . . . . 0.0 109.512 177.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -58.1 -46.74 85.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.893 1.677 . . . . 0.0 112.462 171.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -50.93 -57.97 7.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.205 2.202 . . . . 0.0 112.662 169.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.04 -48.98 43.39 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -178.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 69' ' ' ALA . 3.6 mm? -76.17 -38.97 55.98 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.458 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 12.8 t80 -56.56 -61.77 2.18 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.733 1.213 . . . . 0.0 112.116 173.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 22.3 mmmt -55.18 -37.08 66.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.983 1.713 . . . . 0.0 112.307 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -54.02 -60.55 3.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -83.03 -8.57 59.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.844 -1.785 . . . . 0.0 112.743 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 45.6 m -64.31 -67.68 0.41 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.95 -1.094 . . . . 0.0 111.251 166.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.7 m -87.54 -54.28 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.457 -1.402 . . . . 0.0 113.484 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.72 -28.88 5.57 Favored Glycine 0 N--CA 1.431 -1.688 0 C-N-CA 125.489 1.519 . . . . 0.0 113.402 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -119.49 171.72 8.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.565 1.146 . . . . 0.0 109.095 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -72.98 70.15 1.01 Allowed 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 123.443 1.592 . . . . 0.0 112.078 161.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.19 -41.98 27.1 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.229 -1.545 . . . . 0.0 114.472 -160.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.7 mmpt? -85.47 81.6 8.64 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.712 -1.867 . . . . 0.0 112.778 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -84.29 48.1 1.44 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.023 1.392 . . . . 0.0 113.468 -170.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -153.86 89.89 3.38 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 125.212 1.405 . . . . 0.0 108.201 170.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.5 179.38 6.15 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 122.66 2.24 . . . . 0.0 110.611 169.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.46 -175.15 3.18 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 121.151 3.22 . . . . 0.0 121.151 -161.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 pt -87.34 -50.13 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.28 -1.718 . . . . 0.0 112.378 -170.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -91.07 29.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.614 1.965 . . . . 0.0 111.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.325 42.2 p-10 -61.33 115.08 3.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.861 2.911 . . . . 0.0 118.861 -156.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.5 tpp -126.18 -64.75 1.02 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.97 -42.62 90.34 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.252 1.421 . . . . 0.0 114.285 177.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.77 -27.1 68.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.3 mtm-85 -67.56 -46.35 72.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.335 -1.478 . . . . 0.0 112.008 174.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -57.38 -48.72 78.31 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.298 1.039 . . . . 0.0 113.064 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -54.32 -54.7 36.72 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 125.546 1.538 . . . . 0.0 114.406 172.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -29.35 65.38 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.536 -1.353 . . . . 0.0 113.355 -176.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -69.78 -39.15 76.79 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 126.523 1.929 . . . . 0.0 112.219 174.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.24 -26.17 64.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.788 -1.195 . . . . 0.0 112.158 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.43 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 7.9 t90 -78.86 -45.22 21.19 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.741 2.016 . . . . 0.0 111.53 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -58.94 -20.96 56.93 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.856 2.862 . . . . 0.0 113.812 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -61.16 -30.14 70.21 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.718 -1.864 . . . . 0.0 113.424 168.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 48.4 mt -112.8 9.46 19.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.812 1.245 . . . . 0.0 112.71 -172.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -26.44 -34.0 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.417 2 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -165.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -158.94 32.97 0.47 Allowed Glycine 0 N--CA 1.43 -1.717 0 O-C-N 119.03 -2.294 . . . . 0.0 113.528 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -116.06 -43.49 2.97 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 119.06 1.43 . . . . 0.0 110.256 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -87.56 46.14 1.35 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.45 -1.406 . . . . 0.0 113.779 -161.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -74.59 -38.07 62.73 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.832 -2.418 . . . . 0.0 108.002 158.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.61 -44.99 61.23 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 129.965 3.306 . . . . 0.0 110.282 -177.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -75.02 -47.47 28.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.731 174.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -43.19 -59.59 2.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -47.56 -29.33 2.77 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 120.344 3.461 . . . . 0.0 120.344 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -88.86 -34.41 17.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.432 2.293 . . . . 0.0 114.699 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -73.42 -31.14 63.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.457 -1.402 . . . . 0.0 110.905 174.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.465 ' CE2' HG21 ' A' ' 77' ' ' VAL . 18.8 t80 -67.77 -50.59 56.3 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.654 1.181 . . . . 0.0 112.2 -166.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.98 -47.98 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 167.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.16 48.79 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.08 -43.38 78.69 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.695 -1.253 . . . . 0.0 113.63 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.465 HG21 ' CE2' ' A' ' 73' ' ' TYR . 18.1 t -65.73 -25.46 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.513 1.125 . . . . 0.0 111.3 176.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.41 -41.98 99.1 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.032 -2.292 . . . . 0.0 113.767 171.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.01 -30.88 71.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.075 0.95 . . . . 0.0 113.051 175.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.3 mt -71.41 -57.19 4.67 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.614 1.565 . . . . 0.0 109.816 175.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.441 HD13 HD11 ' A' ' 15' ' ' LEU . 2.6 mm -57.23 -39.46 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 126.402 1.881 . . . . 0.0 113.555 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.22 -35.81 62.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 173.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -87.36 -37.96 16.63 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.014 -1.054 . . . . 0.0 111.4 173.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -101.19 -16.58 16.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.026 1.491 . . . . 0.0 115.026 -157.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 p -47.36 -54.93 9.89 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.26 1.646 0 O-C-N 120.396 -1.44 . . . . 0.0 109.065 172.153 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 122.974 1.368 . . . . 0.0 114.233 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 p -57.85 -35.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.531 2.732 . . . . 0.0 112.991 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -64.71 -39.15 93.16 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.679 -1.263 . . . . 0.0 114.368 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 tp -60.47 -46.5 89.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 124.907 2.289 . . . . 0.0 111.744 176.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -54.26 -42.74 70.28 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 128.739 2.816 . . . . 0.0 109.019 177.291 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -72.85 -39.71 66.28 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.095 0.958 . . . . 0.0 113.258 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.33 -43.36 96.49 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.944 1.354 . . . . 0.0 111.451 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.7 mppt? -90.39 -24.11 20.88 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 114.188 -1.369 . . . . 0.0 114.058 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.6 -45.18 76.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.866 -2.396 . . . . 0.0 113.532 176.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.18 -19.2 43.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.698 1.999 . . . . 0.0 113.836 170.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.06 -58.95 2.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 121.26 -0.9 . . . . 0.0 110.39 170.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.9 m -61.39 -26.14 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.241 -1.537 . . . . 0.0 113.586 -170.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -73.79 -12.66 60.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -144.89 29.6 1.21 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.52 -1.363 . . . . 0.0 112.205 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.4 mt -71.99 156.17 91.14 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.747 -1.846 . . . . 0.0 110.11 175.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -72.47 -24.3 19.27 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.692 2.261 . . . . 0.0 110.605 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -101.97 82.07 2.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 104.304 -2.48 . . . . 0.0 104.304 168.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 52.6 mtmt -56.88 148.59 48.04 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 126.766 2.026 . . . . 0.0 114.139 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 86.9 Cg_exo -64.08 158.38 48.2 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 C-N-CA 123.699 2.932 . . . . 0.0 115.196 -163.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.7 m -74.71 160.56 30.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.77 1.168 . . . . 0.0 113.628 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -64.6 -60.2 3.41 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.72 2.118 . . . . 0.0 116.72 -157.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.31 -23.25 51.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.447 -2.033 . . . . 0.0 112.154 176.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.17 -35.68 66.46 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.767 2.027 . . . . 0.0 112.286 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.2 tp -51.26 -39.27 56.35 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 126.82 2.048 . . . . 0.0 115.348 169.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.98 -32.14 51.14 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.537 -1.977 . . . . 0.0 114.311 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -71.52 -31.4 67.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.878 -1.764 . . . . 0.0 112.992 167.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -67.18 -42.49 84.15 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 127.343 2.257 . . . . 0.0 111.592 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -47.16 -55.01 9.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.481 2.712 . . . . 0.0 112.276 168.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.11 -47.5 65.27 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.512 1.125 . . . . 0.0 113.958 -178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 69' ' ' ALA . 0.6 OUTLIER -66.67 -45.63 78.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 175.219 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.504 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.7 t80 -58.01 -54.74 43.58 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.49 1.516 . . . . 0.0 110.856 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -56.49 -38.69 72.09 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.053 -1.655 . . . . 0.0 113.408 171.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -53.79 -60.97 2.63 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -90.72 -8.32 50.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -178.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 m -64.62 -60.51 3.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 120.419 1.463 . . . . 0.0 113.04 167.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.2 m -88.11 -35.48 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.669 -1.27 . . . . 0.0 114.414 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.01 -23.8 34.11 Favored Glycine 0 N--CA 1.43 -1.744 0 O-C-N 120.333 -1.479 . . . . 0.0 114.728 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -123.97 163.46 21.32 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 118.883 1.342 . . . . 0.0 107.405 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -59.18 84.27 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 155.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.04 -64.67 1.13 Allowed 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.674 -1.891 . . . . 0.0 115.379 -165.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.25 81.61 8.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.227 -1.545 . . . . 0.0 112.867 -174.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -85.11 53.14 2.64 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 124.483 2.087 . . . . 0.0 112.178 -176.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -153.97 87.26 3.68 Favored Pre-proline 0 N--CA 1.43 -1.469 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 167.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -76.43 166.19 27.88 Favored 'Trans proline' 0 C--N 1.299 -2.046 0 C-N-CA 122.06 1.84 . . . . 0.0 108.094 151.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.16 -167.38 27.79 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-N 120.609 1.55 . . . . 0.0 115.868 -167.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -106.95 -42.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 121.486 -1.008 . . . . 0.0 111.436 -162.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -95.71 9.65 39.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.442 1.897 . . . . 0.0 109.679 167.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -82.07 76.36 8.96 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.998 1.319 . . . . 0.0 112.549 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 ptm -70.44 -12.04 61.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -89.12 -56.52 3.25 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.524 -1.36 . . . . 0.0 110.263 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.47 -30.73 67.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.91 1.684 . . . . 0.0 114.037 -175.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -56.1 -45.89 79.29 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.834 -1.792 . . . . 0.0 115.56 173.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -77.36 -42.3 37.07 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.238 1.015 . . . . 0.0 111.468 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -72.52 -34.34 67.52 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.05 1.34 . . . . 0.0 114.362 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -67.23 -30.31 70.18 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.474 -2.016 . . . . 0.0 111.232 168.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.9 -23.65 58.4 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.485 -2.009 . . . . 0.0 112.378 175.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.61 -22.24 64.45 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.386 -2.071 . . . . 0.0 112.762 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -84.19 -54.61 4.69 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.508 1.523 . . . . 0.0 109.509 173.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.16 65.93 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 128.132 2.573 . . . . 0.0 114.967 -175.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -61.23 -30.48 70.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.287 -1.508 . . . . 0.0 112.551 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.4 mp -103.74 29.64 5.64 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.249 1.02 . . . . 0.0 112.814 174.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.61 -46.68 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 175.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -142.36 -6.47 0.74 Allowed Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -169.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -98.42 4.72 48.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.393 2.044 . . . . 0.0 110.416 171.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.0 p -35.04 -51.12 0.52 Allowed 'General case' 0 N--CA 1.43 -1.459 1 C-N-CA 131.786 4.035 . . . . 0.0 117.314 177.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -80.77 -10.5 59.72 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.135 1.374 . . . . 0.0 113.413 -172.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -87.08 -44.4 11.57 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 123.902 0.881 . . . . 0.0 109.808 168.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -90.58 -38.08 13.39 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 119.673 -1.892 . . . . 0.0 113.441 -170.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -54.81 -61.94 1.98 Allowed 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 119.109 0.868 . . . . 0.0 112.866 179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -41.89 -44.22 3.31 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -88.06 -32.19 18.89 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.968 1.707 . . . . 0.0 113.497 -171.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.422 ' HB2' HD21 ' A' ' 30' ' ' LEU . 63.0 mm-40 -78.28 -34.4 48.91 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.555 -1.34 . . . . 0.0 110.883 171.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.442 ' CE2' HG21 ' A' ' 77' ' ' VAL . 11.2 t80 -59.66 -52.27 66.22 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.87 -53.19 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 171.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.43 -40.19 64.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.5 pp -70.41 -44.34 68.15 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 0.0 113.988 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.442 HG21 ' CE2' ' A' ' 73' ' ' TYR . 13.6 t -62.94 -31.35 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.951 1.3 . . . . 0.0 111.757 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -59.54 -40.76 88.27 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.706 -1.871 . . . . 0.0 113.778 174.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -77.37 -22.77 51.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.661 1.584 . . . . 0.0 113.075 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.11 -59.99 3.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.327 1.451 . . . . 0.0 108.892 165.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.8 mt -65.23 -31.77 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.145 -1.597 . . . . 0.0 114.127 -173.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.86 -36.79 49.62 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.031 -1.668 . . . . 0.0 114.522 169.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -87.47 -41.24 13.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.838 -1.164 . . . . 0.0 110.53 174.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -96.61 -13.01 23.18 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -158.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.3 p -52.04 -58.14 7.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 172.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.261 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.539 171.316 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 122.607 1.194 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -79.31 -24.64 42.7 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.638 1.975 . . . . 0.0 113.384 -170.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -75.83 -39.07 57.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.437 -2.04 . . . . 0.0 112.694 171.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.7 tp -64.38 -37.86 89.02 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 123.037 1.399 . . . . 0.0 111.569 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 2.1 t80 -46.63 -44.44 18.32 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.137 1.775 . . . . 0.0 112.028 170.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.62 -38.23 40.35 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 121.148 -0.97 . . . . 0.0 111.855 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -56.27 -50.21 72.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.95 1.3 . . . . 0.0 113.155 174.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HB3' HG11 ' A' ' 77' ' ' VAL . 19.7 mtpp -78.42 -32.85 48.81 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.303 -1.498 . . . . 0.0 113.499 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.63 -45.71 82.0 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.969 -2.332 . . . . 0.0 114.723 -176.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -66.78 -16.87 64.56 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 175.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.16 -59.35 2.82 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.613 -1.304 . . . . 0.0 110.027 164.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.773 HG11 HG13 ' A' ' 77' ' ' VAL . 10.6 m -64.4 -32.46 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 O-C-N 120.552 -1.342 . . . . 0.0 113.68 -167.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -72.55 -10.93 60.39 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -140.62 21.31 2.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.549 1.14 . . . . 0.0 112.505 -177.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.544 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.9 tp -73.96 160.22 82.31 Favored Pre-proline 0 N--CA 1.429 -1.489 0 O-C-N 118.895 -2.378 . . . . 0.0 109.913 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.544 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 94.4 Cg_endo -74.84 -21.59 16.07 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 CA-C-N 124.955 2.805 . . . . 0.0 112.309 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 m -107.87 82.4 1.64 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 102.055 -3.313 . . . . 0.0 102.055 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -63.55 155.31 76.36 Favored Pre-proline 0 N--CA 1.43 -1.458 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.817 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -67.22 150.15 81.66 Favored 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.48 2.12 . . . . 0.0 113.354 -165.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.2 p -80.64 153.94 27.66 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.957 0.884 . . . . 0.0 112.504 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.6 p -75.77 -32.79 60.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 -156.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.86 -31.51 31.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.32 -1.488 . . . . 0.0 109.818 176.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.49 -37.16 82.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.11 1.364 . . . . 0.0 110.373 173.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 mt -54.32 -17.96 3.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.66 -40.13 69.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.058 -2.276 . . . . 0.0 112.923 169.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -66.79 -53.25 34.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.928 0.891 . . . . 0.0 111.248 169.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' A' ' 80' ' ' LEU . 4.1 mm? -67.46 -36.72 81.72 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 119.863 -1.773 . . . . 0.0 115.717 -175.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -62.42 -53.43 55.01 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 120.851 1.659 . . . . 0.0 111.26 173.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.17 -42.46 66.21 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 119.587 1.085 . . . . 0.0 113.34 -178.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 69' ' ' ALA . 4.5 mm? -71.98 -51.08 23.66 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -56.49 -50.77 70.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.048 -1.657 . . . . 0.0 112.526 176.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.498 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 28.1 mmmt -62.94 -33.12 74.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.985 -1.697 . . . . 0.0 113.392 174.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -56.99 -61.43 2.45 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 115.41 1.634 . . . . 0.0 115.41 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB3' ' CE2' ' A' ' 5' ' ' PHE 0.275 . . -79.83 -11.88 59.8 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.676 2.102 . . . . 0.0 116.676 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.1 p -72.34 -50.4 27.04 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 121.577 1.99 . . . . 0.0 111.601 164.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.43 HG11 ' HB2' ' A' ' 40' ' ' ASP . 21.1 t -87.01 -65.15 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.449 -1.407 . . . . 0.0 111.384 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.74 -12.93 46.4 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 128.24 2.829 . . . . 0.0 113.199 -174.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -125.78 153.79 43.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.153 1.781 . . . . 0.0 106.792 170.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.74 100.74 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.317 -2.114 . . . . 0.0 113.891 158.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.43 ' HB2' HG11 ' A' ' 36' ' ' VAL . 23.7 t0 -76.4 -73.63 0.27 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.743 1.617 . . . . 0.0 115.238 -162.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.67 81.33 8.48 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.952 1.301 . . . . 0.0 113.826 -172.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -77.03 43.52 0.36 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.548 2.339 . . . . 0.0 114.071 -173.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.0 ttpt -160.11 82.19 2.27 Favored Pre-proline 0 N--CA 1.43 -1.426 0 O-C-N 120.24 -1.537 . . . . 0.0 109.171 171.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.69 162.03 43.37 Favored 'Trans proline' 0 C--N 1.3 -2.021 0 C-N-CA 122.406 2.071 . . . . 0.0 109.845 170.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.0 -168.49 29.5 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 119.675 2.63 . . . . 0.0 119.675 -160.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.0 pt -110.69 -41.59 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.38 1.872 . . . . 0.0 108.868 -169.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -97.67 4.28 50.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.481 1.513 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.37 113.21 22.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 121.216 -0.927 . . . . 0.0 110.771 170.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -92.2 -30.82 15.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.897 -1.127 . . . . 0.0 109.678 173.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -85.03 -44.19 13.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 123.726 0.81 . . . . 0.0 112.819 -170.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.97 -32.15 67.57 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.326 1.45 . . . . 0.0 113.801 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -52.25 -38.88 59.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -75.28 -47.71 26.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.609 -1.307 . . . . 0.0 112.057 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -53.88 -51.63 63.07 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.284 2.234 . . . . 0.0 112.885 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -28.88 64.22 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.947 -1.096 . . . . 0.0 112.923 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.94 -39.67 79.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.216 -1.552 . . . . 0.0 111.939 175.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.2 -36.27 83.51 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.021 1.329 . . . . 0.0 112.066 174.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.498 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.3 t90 -72.46 -39.92 67.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.172 1.389 . . . . 0.0 113.547 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.72 -21.79 66.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.883 2.073 . . . . 0.0 114.182 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -64.52 -37.29 87.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.494 -2.004 . . . . 0.0 112.961 166.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.02 5.22 52.39 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.47 -1.394 . . . . 0.0 113.524 -175.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -26.61 -39.77 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.437 1 C-N-CA 131.762 4.025 . . . . 0.0 121.671 -160.807 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.92 30.32 0.33 Allowed Glycine 0 N--CA 1.43 -1.701 0 CA-C-N 120.187 1.358 . . . . 0.0 111.604 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -117.48 -61.98 1.63 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.291 -1.123 . . . . 0.0 110.34 173.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -73.15 34.82 0.08 Allowed 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . 0.252 0.7 OUTLIER -68.9 -39.98 79.42 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 130.618 3.567 . . . . 0.0 109.674 152.057 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.06 -35.37 74.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.248 3.019 . . . . 0.0 109.847 -177.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -77.65 -48.04 17.79 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.337 1.455 . . . . 0.0 111.976 166.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 30' ' ' LEU . . . -42.65 -61.72 1.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -175.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -52.99 -23.51 7.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.057 3.355 . . . . 0.0 120.057 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -89.18 -40.91 12.56 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 118.692 -2.505 . . . . 0.0 115.042 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -70.06 -31.59 69.27 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 120.608 -1.308 . . . . 0.0 110.837 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -69.52 -47.34 64.09 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 tt -42.25 -50.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 124.513 1.125 . . . . 0.0 113.945 169.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.52 -43.39 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.6 mt -59.12 -45.0 92.02 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.762 -1.211 . . . . 0.0 113.156 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.773 HG13 HG11 ' A' ' 12' ' ' VAL . 27.4 t -81.99 -25.27 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.429 1.491 . . . . 0.0 111.377 -172.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.01 -29.75 69.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.186 -2.197 . . . . 0.0 113.116 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -70.17 -32.34 70.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.864 -1.147 . . . . 0.0 113.742 170.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD11 ' HG ' ' A' ' 27' ' ' LEU . 5.9 mt -71.28 -56.61 5.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.745 1.618 . . . . 0.0 110.056 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 50.3 mt -60.46 -34.77 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.343 1.457 . . . . 0.0 112.705 -174.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.42 -34.47 61.41 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 172.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 84' ' ' TYR . 9.0 mmpt? -87.46 -37.03 17.33 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.258 1.023 . . . . 0.0 111.184 174.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.407 ' CD1' ' HB2' ' A' ' 83' ' ' LYS . 21.9 m-30 -109.3 -14.53 14.44 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.564 1.691 . . . . 0.0 115.564 -153.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.6 t -43.52 -54.75 4.66 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.324 1.85 . . . . 0.0 115.807 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.26 1.626 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 165.099 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 CA--C 1.49 -1.343 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -56.13 -27.36 53.69 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 118.369 -2.707 . . . . 0.0 114.713 171.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -64.59 -56.72 12.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 168.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.1 tp -53.35 -48.9 68.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.953 2.101 . . . . 0.0 110.987 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 46.6 t80 -44.48 -47.8 10.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.017 2.527 . . . . 0.0 112.396 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -80.21 -29.91 38.61 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.166 -0.959 . . . . 0.0 113.535 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -66.05 -48.74 70.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.88 1.324 . . . . 0.0 112.035 173.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.497 ' HB3' HG11 ' A' ' 77' ' ' VAL . 10.9 mptt -78.32 -30.03 48.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.285 1.434 . . . . 0.0 113.17 -173.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -65.97 -45.13 82.82 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-O 123.74 1.733 . . . . 0.0 114.129 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.4 mmtm -65.02 -20.84 66.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.753 1.621 . . . . 0.0 113.563 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.21 -56.84 4.43 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.001 -1.062 . . . . 0.0 110.268 168.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 77' ' ' VAL . 23.7 m -64.46 -26.69 40.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.476 -1.39 . . . . 0.0 114.255 -170.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -70.42 -29.55 66.18 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.024 -1.047 . . . . 0.0 113.413 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -122.04 27.24 8.14 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.557 1.543 . . . . 0.0 112.029 -171.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.555 HD11 HD13 ' A' ' 81' ' ' ILE . 12.5 mt -72.63 164.98 55.94 Favored Pre-proline 0 N--CA 1.429 -1.496 0 O-C-N 119.652 -1.905 . . . . 0.0 111.492 170.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.95 -28.31 6.21 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.804 2.336 . . . . 0.0 111.193 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 m -97.86 84.24 3.3 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 102.335 -3.209 . . . . 0.0 102.335 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -63.4 161.69 31.77 Favored Pre-proline 0 N--CA 1.43 -1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 113.61 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_exo -65.96 142.97 70.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 121.99 1.746 . . . . 0.0 115.532 -164.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.9 m -70.23 148.59 48.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.772 1.229 . . . . 0.0 111.508 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.0 p -69.12 -34.67 75.4 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -159.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -83.66 -22.79 32.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.418 -1.426 . . . . 0.0 112.632 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.58 -45.12 39.53 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.499 1.119 . . . . 0.0 110.606 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.1 tp -45.98 -35.44 4.73 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.434 2.294 . . . . 0.0 116.366 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.7 mt -55.19 -54.37 44.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.431 1.492 . . . . 0.0 114.97 170.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.63 -40.46 76.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.393 1.077 . . . . 0.0 112.759 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' HD21 ' A' ' 80' ' ' LEU . 4.5 mm? -69.33 -33.89 73.8 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.745 -1.222 . . . . 0.0 113.014 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -57.59 -55.42 35.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.701 1.6 . . . . 0.0 110.548 164.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.85 -54.17 32.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.543 1.137 . . . . 0.0 112.363 -174.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.95 -44.9 94.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.448 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.4 t80 -57.14 -52.82 63.78 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.181 1.467 . . . . 0.0 111.445 177.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.8 mmmt -61.15 -36.9 81.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.494 -2.004 . . . . 0.0 112.912 174.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -56.86 -57.17 13.64 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.998 1.319 . . . . 0.0 114.34 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.609 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -94.13 -0.09 55.5 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.17 -0.956 . . . . 0.0 113.063 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 m -68.51 -60.63 2.29 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.783 -1.198 . . . . 0.0 110.381 162.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.672 HG23 ' H ' ' A' ' 38' ' ' ASP . 4.8 m -87.64 -45.56 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.228 -1.545 . . . . 0.0 114.69 -176.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.23 11.61 41.7 Favored Glycine 0 N--CA 1.43 -1.729 0 C-N-CA 126.153 1.835 . . . . 0.0 115.321 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.672 ' H ' HG23 ' A' ' 36' ' ' VAL . 27.8 m-20 -146.29 178.77 7.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 172.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -75.94 119.92 20.56 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.375 -1.453 . . . . 0.0 111.292 145.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.63 ' HB2' HG21 ' A' ' 36' ' ' VAL . 22.7 t0 -101.02 -80.0 0.5 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.454 -1.404 . . . . 0.0 112.851 -168.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.28 81.77 1.36 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.114 1.766 . . . . 0.0 115.077 -168.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -79.77 61.46 3.72 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.319 1.447 . . . . 0.0 111.458 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -160.37 76.36 2.73 Favored Pre-proline 0 N--CA 1.43 -1.437 0 C-N-CA 125.455 1.502 . . . . 0.0 109.986 162.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -75.9 167.53 26.0 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 CA-C-N 124.098 2.499 . . . . 0.0 109.953 166.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.32 -172.86 32.03 Favored Glycine 0 N--CA 1.43 -1.737 0 CA-C-N 121.182 1.81 . . . . 0.0 115.852 -168.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.6 pt -102.32 -49.09 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 124.739 1.216 . . . . 0.0 109.568 -166.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.16 32.95 4.56 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.477 1.911 . . . . 0.0 107.71 167.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -95.41 94.29 7.73 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 120.617 -1.302 . . . . 0.0 108.364 169.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -69.61 -43.38 72.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 111.279 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -59.46 -56.09 26.43 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.724 2.01 . . . . 0.0 112.802 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 21.8 m-20 -66.15 -31.06 71.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -61.07 -41.85 97.4 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.118 -1.614 . . . . 0.0 115.121 170.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -66.63 -47.75 71.62 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.104 -0.998 . . . . 0.0 113.185 173.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 51' ' ' ASP . 91.3 mttt -56.98 -46.49 82.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.306 1.443 . . . . 0.0 113.649 177.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.06 -31.53 67.97 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.715 -1.241 . . . . 0.0 113.119 -176.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -69.09 -37.05 78.24 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.965 -1.71 . . . . 0.0 112.182 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.42 67.62 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.443 -1.41 . . . . 0.0 112.657 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.7 t90 -80.81 -49.16 11.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.59 1.956 . . . . 0.0 111.456 177.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -55.27 -30.62 60.46 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.804 2.842 . . . . 0.0 112.781 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -49.9 -38.15 34.56 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.159 -1.588 . . . . 0.0 115.206 167.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.9 mp -116.78 38.85 3.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 122.343 1.068 . . . . 0.0 111.263 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -39.21 -41.78 0.9 Allowed 'General case' 0 N--CA 1.429 -1.491 1 N-CA-C 122.339 4.199 . . . . 0.0 122.339 174.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -109.43 -44.64 1.05 Allowed Glycine 0 N--CA 1.431 -1.653 0 CA-C-N 120.516 1.507 . . . . 0.0 113.476 -173.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptmm? -94.1 17.4 12.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 124.689 2.185 . . . . 0.0 112.135 -167.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -45.72 -50.59 13.6 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 131.527 3.931 . . . . 0.0 117.488 -170.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -67.28 -34.52 77.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 122.331 1.063 . . . . 0.0 113.186 -168.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -77.93 -45.04 25.13 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.709 2.003 . . . . 0.0 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -93.1 -14.45 27.24 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.621 -1.299 . . . . 0.0 111.603 -167.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.609 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -65.87 -62.35 1.55 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.223 -1.548 . . . . 0.0 113.451 162.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -44.57 -44.1 8.54 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 118.857 2.91 . . . . 0.0 118.857 -173.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 -21.34 24.67 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.319 -1.488 . . . . 0.0 113.879 -171.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -89.99 -25.76 20.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.98 -1.075 . . . . 0.0 111.193 172.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.91 -48.43 71.45 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 tt -39.16 -52.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 171.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.67 -20.62 56.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.16 -56.02 6.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.33 -1.481 . . . . 0.0 110.056 167.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG11 ' HB3' ' A' ' 8' ' ' LYS . 39.0 t -68.65 -27.27 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 124.876 1.271 . . . . 0.0 111.403 -167.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -63.52 -40.43 97.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.029 -1.669 . . . . 0.0 113.813 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -74.05 -26.57 60.47 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.999 -1.063 . . . . 0.0 113.161 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.405 HD21 ' HG ' ' A' ' 27' ' ' LEU . 9.4 mp -66.08 -61.38 2.07 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.592 1.157 . . . . 0.0 108.587 168.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.555 HD13 HD11 ' A' ' 15' ' ' LEU . 1.9 mm -54.31 -40.41 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 126.211 1.804 . . . . 0.0 113.997 -176.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.36 -38.55 59.04 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -87.53 -39.55 15.04 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.392 -1.443 . . . . 0.0 112.966 172.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.412 ' HB3' HD13 ' A' ' 15' ' ' LEU . 3.0 m-30 -86.18 -17.54 34.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.504 -1.373 . . . . 0.0 112.63 -162.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.2 m -47.05 -57.42 5.06 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 170.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 C--O 1.261 1.69 0 O-C-N 121.053 -1.029 . . . . 0.0 108.906 174.93 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.569 HG12 ' H ' ' A' ' 4' ' ' LEU . 2.3 t . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 m -70.64 -19.66 62.8 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.724 2.81 . . . . 0.0 113.66 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -68.84 -43.31 75.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.185 -2.197 . . . . 0.0 112.911 171.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.569 ' H ' HG12 ' A' ' 1' ' ' VAL . 53.4 tp -59.7 -48.79 80.28 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.312 1.445 . . . . 0.0 109.973 174.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 30.6 t80 -44.47 -49.54 9.81 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.266 1.827 . . . . 0.0 112.615 176.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -74.95 -38.44 61.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.988 -1.07 . . . . 0.0 112.635 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.23 -50.28 74.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.7 1.2 . . . . 0.0 112.511 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' HB3' HG11 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -85.59 -25.37 26.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.623 1.169 . . . . 0.0 112.747 -174.288 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.473 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.31 -46.51 73.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.603 -1.936 . . . . 0.0 113.44 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -62.49 -20.02 64.17 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.649 1.179 . . . . 0.0 113.888 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.07 -57.24 3.95 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.594 1.158 . . . . 0.0 111.366 169.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -63.71 -28.41 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.555 -1.341 . . . . 0.0 113.789 -171.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -72.65 -14.21 61.54 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -133.7 11.22 4.03 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.529 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.6 tp -66.5 150.78 97.0 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 126.625 1.97 . . . . 0.0 111.656 -176.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.529 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 56.1 Cg_endo -75.81 -14.54 19.41 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.165 2.577 . . . . 0.0 111.803 -172.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.7 m -105.27 77.79 1.33 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 102.264 -3.235 . . . . 0.0 102.264 170.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.66 151.15 72.73 Favored Pre-proline 0 N--CA 1.431 -1.407 0 C-N-CA 125.503 1.521 . . . . 0.0 113.663 -171.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -64.04 149.9 89.5 Favored 'Trans proline' 0 N--CA 1.434 -1.979 0 C-N-CA 122.864 2.376 . . . . 0.0 113.173 -167.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m -71.02 160.69 32.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 120.693 1.588 . . . . 0.0 112.446 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.0 t -57.13 -47.85 80.1 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.928 -1.732 . . . . 0.0 115.354 -171.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -77.29 -26.48 52.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.43 -1.419 . . . . 0.0 112.452 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.67 -53.45 27.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.635 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.3 tp -48.31 -30.48 4.91 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 127.234 2.213 . . . . 0.0 116.599 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.74 -51.34 65.37 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.458 -1.401 . . . . 0.0 114.269 172.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -80.12 -32.88 39.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.904 -1.122 . . . . 0.0 112.499 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.93 -26.25 62.22 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.992 -1.693 . . . . 0.0 111.751 174.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.91 -57.67 11.89 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.237 1.415 . . . . 0.0 109.925 161.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.95 -53.26 27.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.096 1.358 . . . . 0.0 113.79 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD21 ' HB2' ' A' ' 72' ' ' GLU . 1.1 mp -65.2 -41.17 94.77 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 116.444 2.016 . . . . 0.0 116.444 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.473 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.7 t80 -62.24 -50.13 72.98 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.377 1.56 . . . . 0.0 111.332 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.441 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.8 mmmt -61.11 -33.71 73.81 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.834 -1.791 . . . . 0.0 113.077 172.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -59.48 -61.07 2.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.742 -1.224 . . . . 0.0 114.248 176.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.278 . . -86.45 -7.44 58.42 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.4 p -70.82 -55.6 8.17 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.929 2.15 . . . . 0.0 111.636 163.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.1 t -72.96 -58.21 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.512 -1.368 . . . . 0.0 111.469 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.9 -1.4 59.55 Favored Glycine 0 N--CA 1.43 -1.725 0 C-N-CA 126.365 1.936 . . . . 0.0 113.016 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -141.87 168.46 19.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -58.95 137.41 57.9 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.442 -1.411 . . . . 0.0 114.16 150.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -113.35 -86.19 0.58 Allowed 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.799 -1.813 . . . . 0.0 113.009 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -84.62 86.84 7.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.562 -1.336 . . . . 0.0 111.405 -169.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -80.22 53.4 1.75 Allowed 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 123.932 1.825 . . . . 0.0 112.889 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.89 77.42 2.81 Favored Pre-proline 0 N--CA 1.43 -1.448 0 C-N-CA 127.549 2.34 . . . . 0.0 109.28 169.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.63 151.94 58.81 Favored 'Trans proline' 0 C--N 1.299 -2.062 0 O-C-N 117.918 -1.675 . . . . 0.0 108.264 152.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.86 172.15 51.46 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 120.469 1.486 . . . . 0.0 114.533 -170.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.3 pp -92.6 -40.41 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.361 0 O-C-N 120.429 -1.63 . . . . 0.0 110.575 -159.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -86.76 -2.17 58.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.092 1.757 . . . . 0.0 110.275 164.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -83.18 71.46 10.18 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.855 -1.153 . . . . 0.0 111.943 -173.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.6 mmt -54.1 -47.01 72.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.223 1.409 . . . . 0.0 114.156 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -64.67 -42.8 95.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.58 1.152 . . . . 0.0 113.899 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -67.91 -39.86 83.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.772 -1.205 . . . . 0.0 112.901 175.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -57.3 -43.91 83.63 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.353 -1.467 . . . . 0.0 114.68 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -59.52 -49.48 77.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.458 -1.401 . . . . 0.0 114.368 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -72.97 -33.25 65.75 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.047 -1.033 . . . . 0.0 113.378 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -70.69 -37.36 73.59 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.771 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.05 -33.29 73.36 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.51 -1.994 . . . . 0.0 112.207 173.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.81 -23.77 67.34 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.725 -1.234 . . . . 0.0 112.632 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.441 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -83.89 -54.46 4.86 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.613 1.965 . . . . 0.0 111.139 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -54.76 -24.56 22.96 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 130.501 3.52 . . . . 0.0 115.035 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -57.07 -32.08 65.88 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 118.571 -2.58 . . . . 0.0 113.726 166.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.2 mp -116.88 41.01 2.83 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 122.458 1.123 . . . . 0.0 111.399 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -49.92 -26.81 4.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 172.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -116.14 -44.96 0.6 Allowed Glycine 0 N--CA 1.43 -1.702 0 CA-C-N 119.365 0.984 . . . . 0.0 113.443 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -96.0 16.56 17.55 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.089 1.9 . . . . 0.0 112.21 -171.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.04 -50.53 8.34 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 129.8 3.24 . . . . 0.0 116.939 -172.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -76.95 -10.66 59.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -86.42 -50.27 7.02 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 174.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -29.3 16.94 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -166.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -56.06 -61.46 2.36 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.173 -0.954 . . . . 0.0 113.239 176.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -47.16 -32.17 4.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 177.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -85.32 -33.41 22.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.921 -1.737 . . . . 0.0 114.35 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.474 ' HB2' HD21 ' A' ' 30' ' ' LEU . 5.8 mm-40 -84.97 -32.47 22.99 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.416 -1.428 . . . . 0.0 109.901 173.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -63.97 -46.67 83.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.335 -1.478 . . . . 0.0 114.363 -171.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.2 tt -39.02 -56.48 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 167.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -31.42 65.23 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.32 -55.54 17.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.246 1.018 . . . . 0.0 111.579 172.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.419 HG11 ' HB3' ' A' ' 8' ' ' LYS . 38.4 t -71.67 -24.88 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.133 1.773 . . . . 0.0 111.261 -170.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.23 -34.59 78.72 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.76 -1.838 . . . . 0.0 112.968 171.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -76.87 -26.59 54.41 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.804 -1.185 . . . . 0.0 112.842 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.59 -61.81 1.71 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.826 -1.171 . . . . 0.0 108.558 169.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.56 -41.67 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.607 1.563 . . . . 0.0 113.777 -172.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.53 67.44 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -87.18 -36.0 18.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.575 1.55 . . . . 0.0 110.542 173.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -103.56 -22.0 13.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -157.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -39.42 -54.99 1.84 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.261 1.668 0 C-N-CA 123.848 0.859 . . . . 0.0 110.872 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.511 ' HB ' HD21 ' A' ' 4' ' ' LEU . 4.4 t . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 121.051 0.453 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -80.75 -2.33 46.53 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.682 -1.886 . . . . 0.0 114.011 -166.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -74.04 -60.69 2.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.451 -1.406 . . . . 0.0 110.698 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -62.27 -32.38 73.08 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 126.199 1.8 . . . . 0.0 111.594 178.323 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 78.0 t80 -50.03 -55.07 16.21 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.876 1.67 . . . . 0.0 111.691 175.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.45 -28.9 52.55 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.918 -1.114 . . . . 0.0 111.958 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -45.75 91.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.584 1.154 . . . . 0.0 112.457 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.501 ' HB3' HG11 ' A' ' 77' ' ' VAL . 12.7 mptt -84.39 -26.86 28.05 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.237 -1.539 . . . . 0.0 112.99 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.479 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -49.68 64.75 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.986 1.851 . . . . 0.0 114.32 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.33 -18.55 64.74 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.914 -1.494 . . . . 0.0 113.247 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.61 -62.32 1.49 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 110.16 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.604 HG11 HG13 ' A' ' 77' ' ' VAL . 32.4 m -63.61 -31.12 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 120.322 1.419 . . . . 0.0 113.825 -169.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -72.89 -10.21 59.55 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.056 -1.027 . . . . 0.0 113.465 176.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -144.55 36.57 1.19 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.654 1.216 . . . . 0.0 112.457 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -71.7 168.82 19.03 Favored Pre-proline 0 N--CA 1.431 -1.417 0 O-C-N 119.81 -1.806 . . . . 0.0 110.969 170.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -76.23 -27.48 8.05 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 124.563 2.665 . . . . 0.0 110.756 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 90.2 m -106.79 75.52 1.06 Allowed 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -60.49 157.51 35.71 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -68.05 143.74 61.08 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 122.756 2.02 . . . . 0.0 114.668 -159.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -82.24 152.59 26.31 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.448 -0.783 . . . . 0.0 112.696 175.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.9 m -54.06 -54.21 42.45 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -161.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -70.23 -13.23 62.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.334 -1.479 . . . . 0.0 113.893 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -87.04 -55.65 3.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.149 1.379 . . . . 0.0 107.851 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -42.29 -45.21 4.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 128.626 2.77 . . . . 0.0 116.811 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -50.34 -56.63 10.48 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -71.82 -35.5 69.94 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 112.688 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -64.63 -41.29 96.26 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.368 -1.457 . . . . 0.0 113.066 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -53.21 -50.0 65.58 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.48 1.912 . . . . 0.0 111.846 167.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.93 -46.95 75.0 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 69' ' ' ALA . 4.4 mp -66.57 -49.82 65.13 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 172.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.479 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.0 t80 -51.75 -52.52 48.09 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.032 1.733 . . . . 0.0 111.379 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.0 mmmt -68.74 -25.62 64.83 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.258 -1.526 . . . . 0.0 113.034 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -63.15 -54.29 40.08 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.481 -2.012 . . . . 0.0 116.008 172.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.266 . . -93.97 -0.08 55.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.003 -1.686 . . . . 0.0 112.693 -178.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -71.94 -59.7 2.61 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.066 -1.646 . . . . 0.0 111.157 157.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.5 t -85.24 -61.94 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.046 -1.659 . . . . 0.0 113.351 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.99 -8.91 50.47 Favored Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 126.781 2.134 . . . . 0.0 114.254 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -130.92 158.66 39.63 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.827 -2.286 . . . . 0.0 104.827 170.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.33 120.44 9.28 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.646 -1.909 . . . . 0.0 113.512 151.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -93.18 -81.27 0.36 Allowed 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.102 -1.624 . . . . 0.0 113.125 -165.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -78.94 86.58 4.81 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.077 1.351 . . . . 0.0 113.176 -169.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.8 48.89 0.85 Allowed 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.476 1.911 . . . . 0.0 112.409 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -160.31 86.8 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.433 0 C-N-CA 128.053 2.541 . . . . 0.0 107.407 168.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.71 159.93 47.48 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.269 1.979 . . . . 0.0 108.776 157.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.23 -160.95 12.7 Favored Glycine 0 N--CA 1.431 -1.696 0 N-CA-C 117.737 1.855 . . . . 0.0 117.737 -165.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 28.8 pt -100.13 -50.39 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.24 -1.153 . . . . 0.0 111.194 -161.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -94.67 -1.58 52.84 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.158 1.783 . . . . 0.0 110.146 169.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -77.54 69.83 3.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.573 1.549 . . . . 0.0 115.075 -169.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.2 mmt -54.62 -46.8 73.95 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 125.81 1.644 . . . . 0.0 114.251 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -61.7 -45.14 95.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -61.23 -41.77 97.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.705 -1.247 . . . . 0.0 114.107 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.8 mtp85 -62.37 -40.24 95.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -62.05 -52.6 63.29 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.0 -1.688 . . . . 0.0 113.79 171.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -69.6 -30.66 68.46 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.334 -1.479 . . . . 0.0 113.78 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -71.01 -33.0 69.93 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.988 -1.695 . . . . 0.0 112.799 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -68.48 -34.95 76.83 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.524 -1.985 . . . . 0.0 112.235 171.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.86 -28.33 68.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.346 -1.471 . . . . 0.0 112.654 175.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.7 t90 -79.03 -39.09 34.92 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.193 1.797 . . . . 0.0 112.277 175.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -66.29 -14.41 61.96 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.888 1.675 . . . . 0.0 113.636 175.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -74.04 -16.4 61.05 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 117.744 -3.098 . . . . 0.0 113.807 165.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 mt -110.95 -14.68 13.91 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.968 -1.708 . . . . 0.0 113.814 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.259 0.3 OUTLIER -27.69 -32.93 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 2 N-CA-C 124.41 4.967 . . . . 0.0 124.41 -154.525 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.82 15.03 2.19 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 121.139 1.79 . . . . 0.0 110.839 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -109.85 -61.48 1.64 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 123.333 1.54 . . . . 0.0 108.719 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.7 m -87.52 43.36 1.1 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.809 -1.087 . . . . 0.0 113.571 -159.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -76.02 -37.32 58.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.9 1.68 . . . . 0.0 107.22 157.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.47 -26.53 65.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 128.758 2.823 . . . . 0.0 111.587 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -86.93 -48.42 8.17 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.904 1.281 . . . . 0.0 111.739 165.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.482 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -42.63 -59.69 1.82 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.0 -29.35 3.39 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -89.59 -61.16 1.76 Allowed 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.301 -2.124 . . . . 0.0 113.66 172.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -70.06 -18.72 63.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.435 1.094 . . . . 0.0 111.886 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.14 -51.87 66.14 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.111 -0.993 . . . . 0.0 112.562 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.415 ' HB ' HD12 ' A' ' 4' ' ' LEU . 10.5 tt -59.46 -32.75 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 176.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.73 84.11 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.016 -1.678 . . . . 0.0 114.795 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -69.62 -44.24 71.08 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.671 -1.268 . . . . 0.0 112.199 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.604 HG13 HG11 ' A' ' 12' ' ' VAL . 24.2 t -69.37 -25.12 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.804 2.041 . . . . 0.0 110.844 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -62.74 -37.4 86.41 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.846 -1.784 . . . . 0.0 112.981 170.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -75.05 -19.05 60.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -75.36 -60.26 2.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.74 1.616 . . . . 0.0 108.823 169.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.0 mm -53.44 -36.74 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 C-N-CA 128.458 2.703 . . . . 0.0 113.661 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.05 34.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 172.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -87.77 -50.99 6.11 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.81 -1.182 . . . . 0.0 112.092 163.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -89.81 -13.99 35.43 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 -150.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.0 t -48.3 -54.83 12.37 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.007 1.723 . . . . 0.0 114.111 176.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 C--O 1.26 1.645 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 172.79 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.4 t -86.68 6.8 29.41 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 129.645 3.178 . . . . 0.0 114.613 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -65.99 -54.44 26.14 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 118.874 -2.391 . . . . 0.0 110.901 174.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -63.29 -35.65 81.06 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.571 2.748 . . . . 0.0 111.746 179.02 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 64.4 t80 -52.46 -55.59 20.86 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.05 1.74 . . . . 0.0 110.157 175.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.75 -33.95 62.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.068 -1.02 . . . . 0.0 112.807 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.15 85.34 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.961 1.704 . . . . 0.0 112.401 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' A' ' 77' ' ' VAL . 39.5 mmtm -90.91 -33.05 15.77 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.345 -1.472 . . . . 0.0 114.6 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.92 98.64 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.981 -2.324 . . . . 0.0 114.583 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -67.09 -16.07 64.11 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 124.419 1.088 . . . . 0.0 112.473 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.99 -54.18 6.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.628 -1.295 . . . . 0.0 111.987 163.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.455 HG11 HG13 ' A' ' 77' ' ' VAL 0.253 1.9 m -65.92 -26.6 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 O-C-N 120.312 -1.492 . . . . 0.0 113.598 -172.67 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -68.35 -10.74 57.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -155.78 47.74 0.5 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.113 1.435 . . . . 0.0 110.544 171.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.89 154.81 94.51 Favored Pre-proline 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 0.0 110.808 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.64 -19.08 11.6 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 124.584 2.673 . . . . 0.0 111.364 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 m -115.68 77.48 1.09 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 101.075 -3.676 . . . . 0.0 101.075 173.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.5 mtpt -53.0 148.85 13.12 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -173.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 91.9 Cg_exo -58.74 147.26 88.98 Favored 'Trans proline' 0 N--CA 1.433 -2.066 0 C-N-CA 124.074 3.183 . . . . 0.0 113.62 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -73.59 167.69 20.82 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.031 1.287 . . . . 0.0 113.383 -168.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 t -59.75 -42.92 94.3 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -164.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -85.09 -18.42 34.34 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.586 1.154 . . . . 0.0 112.905 173.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -76.67 -48.28 19.47 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 110.966 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.5 tp -45.46 -27.02 0.64 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 129.289 3.036 . . . . 0.0 116.808 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.7 mt -79.44 -49.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.829 2.452 . . . . 0.0 113.37 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.5 -39.7 92.19 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.138 -1.601 . . . . 0.0 112.858 171.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.781 1.633 . . . . 0.0 111.888 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.72 -56.49 21.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.213 1.405 . . . . 0.0 111.518 165.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -44.46 65.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.08 -41.95 60.91 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 175.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -62.16 -50.45 71.79 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.229 -1.544 . . . . 0.0 111.195 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 23.5 mmmt -57.14 -38.81 74.04 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.974 -1.704 . . . . 0.0 113.023 169.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -52.11 -61.65 2.13 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 120.243 1.383 . . . . 0.0 114.655 176.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.268 . . -87.69 -13.06 43.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 118.764 -1.175 . . . . 0.0 113.627 -176.816 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.5 m -65.0 -59.13 4.49 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.368 1.44 . . . . 0.0 112.574 170.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.3 m -88.12 -31.35 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.372 -1.455 . . . . 0.0 114.3 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.19 -6.52 61.72 Favored Glycine 0 N--CA 1.431 -1.691 0 O-C-N 119.535 -1.978 . . . . 0.0 116.405 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -143.35 172.36 12.87 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -61.41 92.68 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.9 -1.125 . . . . 0.0 113.433 153.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.34 -64.34 1.17 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.823 -1.798 . . . . 0.0 114.626 -163.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -90.03 81.65 6.2 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.006 -1.684 . . . . 0.0 111.99 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -72.38 21.51 0.06 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.071 2.148 . . . . 0.0 116.509 -165.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -149.64 96.22 3.63 Favored Pre-proline 0 N--CA 1.429 -1.492 0 C-N-CA 126.722 2.009 . . . . 0.0 107.096 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -75.68 -179.0 4.71 Favored 'Trans proline' 0 N--CA 1.433 -2.059 0 C-N-CA 122.734 2.29 . . . . 0.0 110.836 163.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.6 179.97 32.72 Favored Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.548 -1.345 . . . . 0.0 113.7 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.0 pt -95.42 -44.38 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 121.084 -1.245 . . . . 0.0 108.207 -165.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -102.37 9.81 39.52 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.731 1.612 . . . . 0.0 109.796 171.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -75.83 87.08 2.82 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 121.129 -0.982 . . . . 0.0 111.107 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.4 tpt -70.95 -26.33 63.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.708 1.603 . . . . 0.0 112.701 -169.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -58.48 3.26 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.281 -1.512 . . . . 0.0 111.83 172.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -63.94 -29.95 71.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -174.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -53.9 -35.49 61.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 170.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -87.49 -46.84 9.24 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.459 -1.401 . . . . 0.0 111.929 173.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -81.41 -16.73 51.27 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.758 -1.839 . . . . 0.0 114.097 -167.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -71.42 -31.56 67.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.932 -1.73 . . . . 0.0 110.78 164.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -70.65 -28.27 64.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.429 -2.044 . . . . 0.0 112.397 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.62 -18.3 64.28 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.316 -1.49 . . . . 0.0 113.604 169.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.421 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -88.38 -52.47 5.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.313 1.845 . . . . 0.0 109.873 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -11.38 37.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.874 -1.766 . . . . 0.0 115.057 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -50.2 -36.52 31.02 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.192 -1.567 . . . . 0.0 113.109 161.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.27 40.85 2.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.462 1.505 . . . . 0.0 112.283 175.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -34.57 -41.3 0.12 Allowed 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 123.611 4.671 . . . . 0.0 123.611 171.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -137.1 -15.01 0.82 Allowed Glycine 0 N--CA 1.429 -1.78 0 CA-C-N 121.438 1.927 . . . . 0.0 113.241 -165.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -102.27 17.96 22.13 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 124.599 2.142 . . . . 0.0 109.43 178.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -52.21 -52.05 54.62 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.783 2.833 . . . . 0.0 116.092 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -76.74 -10.45 59.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.199 -1.563 . . . . 0.0 113.92 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -89.93 -40.65 12.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 123.717 0.807 . . . . 0.0 110.228 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -93.18 -45.7 7.75 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.912 -1.117 . . . . 0.0 113.417 -175.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -55.16 -50.3 69.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -174.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -41.95 -43.14 3.02 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.702 2.482 . . . . 0.0 117.702 171.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -88.83 -44.97 10.11 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.344 1.857 . . . . 0.0 111.55 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.16 -24.51 59.41 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.921 -1.112 . . . . 0.0 112.59 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.447 ' CE2' HG21 ' A' ' 77' ' ' VAL . 30.9 t80 -67.86 -53.41 26.95 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.002 0.921 . . . . 0.0 112.875 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.1 tt -50.4 -36.3 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.97 -37.25 81.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.654 -1.904 . . . . 0.0 114.786 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.2 mt -66.87 -47.99 70.18 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.569 -1.332 . . . . 0.0 111.863 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.455 HG13 HG11 ' A' ' 12' ' ' VAL . 50.5 t -73.66 -24.29 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.581 1.552 . . . . 0.0 111.436 -171.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.93 -35.0 76.29 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.309 -2.119 . . . . 0.0 112.757 170.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -69.55 -31.69 70.05 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.309 -1.495 . . . . 0.0 112.394 173.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.08 -63.6 1.03 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.599 1.959 . . . . 0.0 109.247 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mt -68.1 -30.14 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 120.389 -1.444 . . . . 0.0 113.432 -168.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.16 -29.88 58.7 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -87.73 -47.54 8.56 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.659 -1.276 . . . . 0.0 111.847 167.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -98.67 -7.68 27.47 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.361 1.465 . . . . 0.0 114.699 -152.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 46.2 t -46.54 -54.92 8.39 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.967 1.707 . . . . 0.0 114.868 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.26 1.634 0 C-N-CA 124.1 0.96 . . . . 0.0 109.522 167.139 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 CA--C 1.49 -1.333 0 CA-C-O 122.277 1.036 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 m -52.65 -28.39 21.35 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 130.451 3.5 . . . . 0.0 115.328 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -74.99 -48.29 24.89 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.573 -1.329 . . . . 0.0 111.118 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.2 tp -56.93 -46.33 82.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.466 1.506 . . . . 0.0 111.308 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -43.73 -53.1 6.11 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.909 2.084 . . . . 0.0 112.278 -175.039 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.38 -31.17 20.25 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.286 -0.884 . . . . 0.0 110.965 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -58.96 -42.73 90.61 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.379 1.072 . . . . 0.0 113.008 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.411 ' HB3' HG11 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -90.89 -21.75 21.25 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 125.126 1.371 . . . . 0.0 113.148 177.118 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.4 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -65.84 -47.18 75.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.268 -2.145 . . . . 0.0 113.136 171.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -65.28 -18.61 65.45 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.68 -59.17 2.89 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 123.496 0.719 . . . . 0.0 110.355 167.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.408 HG11 HG13 ' A' ' 77' ' ' VAL . 35.9 m -61.83 -30.72 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 O-C-N 120.545 -1.347 . . . . 0.0 113.308 -171.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -69.17 -23.0 63.88 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -130.77 33.66 4.2 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 123.744 0.817 . . . . 0.0 111.933 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.3 mt -74.11 158.37 85.73 Favored Pre-proline 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 0.0 110.238 172.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -75.51 -24.37 12.1 Favored 'Trans proline' 0 C--N 1.299 -2.041 0 C-N-CA 122.752 2.302 . . . . 0.0 110.848 -176.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.1 m -100.71 83.24 2.54 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 169.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -61.09 155.13 57.21 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 126.6 1.96 . . . . 0.0 113.644 -173.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -61.6 142.29 94.12 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.931 2.421 . . . . 0.0 115.084 -168.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m -76.65 159.07 30.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 t -61.98 -37.79 86.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -160.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -90.31 -23.76 21.07 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.669 -1.894 . . . . 0.0 112.854 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -72.16 -50.56 26.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.921 2.089 . . . . 0.0 110.374 -176.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.0 tp -42.06 -38.78 1.75 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.522 2.329 . . . . 0.0 116.465 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.474 HD22 ' HG2' ' A' ' 54' ' ' LYS . 25.3 mt -72.72 -45.25 59.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.147 2.179 . . . . 0.0 114.908 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.44 -39.86 94.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.395 1.878 . . . . 0.0 111.514 172.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.62 -28.61 40.94 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.652 1.981 . . . . 0.0 112.671 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -52.2 -55.05 23.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.138 2.175 . . . . 0.0 110.334 167.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.43 -53.12 31.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.638 0.775 . . . . 0.0 112.904 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 -43.63 93.8 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 174.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.4 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.7 t80 -56.85 -57.18 13.59 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.323 -1.486 . . . . 0.0 111.142 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -57.05 -37.01 71.18 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.697 1.999 . . . . 0.0 113.6 174.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 44.5 mt-30 -53.3 -59.85 4.04 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.361 0.982 . . . . 0.0 113.314 174.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.524 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -86.06 -10.0 55.75 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.117 -0.989 . . . . 0.0 113.33 -176.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 48.0 m -66.21 -59.44 3.75 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.17 -0.956 . . . . 0.0 111.706 170.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 40' ' ' ASP . 1.3 p -87.42 -56.72 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.354 -1.466 . . . . 0.0 114.631 174.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.84 -9.81 23.34 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 115.762 1.065 . . . . 0.0 115.762 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -132.64 163.46 28.87 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 172.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -67.78 79.59 0.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.043 -1.661 . . . . 0.0 114.343 162.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.401 ' HB2' HG21 ' A' ' 36' ' ' VAL . 32.8 t0 -77.57 -54.74 6.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.304 -2.123 . . . . 0.0 115.296 -161.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.8 mmpt? -87.11 81.72 7.93 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.031 -1.668 . . . . 0.0 112.982 -171.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -83.69 51.61 2.06 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.063 1.887 . . . . 0.0 110.657 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.0 tttp -155.65 84.36 3.48 Favored Pre-proline 0 N--CA 1.429 -1.494 0 C-N-CA 127.787 2.435 . . . . 0.0 107.629 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.53 -165.8 0.35 Allowed 'Trans proline' 0 C--N 1.3 -2.002 0 C-N-CA 123.254 2.636 . . . . 0.0 110.63 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.29 -176.61 44.75 Favored Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 121.676 2.034 . . . . 0.0 114.636 -179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -98.93 -52.36 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 121.346 -1.09 . . . . 0.0 108.777 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -94.53 5.27 52.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.464 1.506 . . . . 0.0 110.921 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -64.92 121.36 14.46 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 121.256 -0.903 . . . . 0.0 112.54 -174.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 99.3 mmm -85.11 -36.95 20.8 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.686 -1.259 . . . . 0.0 111.289 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -76.4 -53.38 8.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.368 1.467 . . . . 0.0 112.543 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -56.76 -37.45 71.07 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -171.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -51.63 -43.26 62.52 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.703 1.742 . . . . 0.0 115.703 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.261 51.5 p90 -87.49 -39.08 15.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.333 -1.48 . . . . 0.0 113.682 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 25' ' ' LEU 0.325 0.0 OUTLIER -84.14 -16.35 43.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -178.587 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -70.45 -34.0 71.94 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.667 -1.896 . . . . 0.0 110.182 162.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -77.54 -20.06 54.74 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.468 -2.02 . . . . 0.0 112.456 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.58 -24.23 61.87 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.928 -1.732 . . . . 0.0 112.909 166.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.42 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 12.2 t90 -80.49 -47.36 14.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.373 1.869 . . . . 0.0 108.35 175.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -53.3 -21.27 5.29 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.716 2.806 . . . . 0.0 114.31 171.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -68.29 -24.67 64.89 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 118.675 -2.516 . . . . 0.0 113.169 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.94 19.2 14.46 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.066 -1.021 . . . . 0.0 112.92 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -27.74 -35.39 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 1 N-CA-C 122.693 4.331 . . . . 0.0 122.693 -178.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -124.61 -27.62 1.27 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.266 1.413 . . . . 0.0 114.452 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 ptmm? -92.06 -5.8 52.18 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.249 -1.736 . . . . 0.0 112.887 -175.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.8 m -26.3 -63.3 0.07 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 131.178 3.791 . . . . 0.0 117.36 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -15.31 63.53 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 -166.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -93.04 -40.3 10.6 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.613 1.165 . . . . 0.0 111.837 172.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.75 -31.18 15.16 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.172 -1.58 . . . . 0.0 113.387 -168.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -53.07 -62.51 1.61 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.032 1.333 . . . . 0.0 112.69 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -42.21 -44.74 3.87 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -87.16 -25.38 24.11 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.009 -1.682 . . . . 0.0 113.726 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -79.07 -35.47 42.39 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.553 -1.342 . . . . 0.0 110.343 169.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -58.84 -50.88 72.32 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.4 tt -38.61 -52.98 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 172.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.8 -21.44 51.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.9 mt -74.53 -50.26 18.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.61 -1.306 . . . . 0.0 111.154 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 8' ' ' LYS . 37.6 t -67.41 -23.4 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.308 1.843 . . . . 0.0 110.712 -174.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -46.37 81.01 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.451 -1.406 . . . . 0.0 113.745 166.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -74.72 -26.1 59.58 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.274 1.83 . . . . 0.0 113.451 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 7.0 mp -64.92 -59.73 3.85 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.413 -1.429 . . . . 0.0 107.767 168.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.15 -34.17 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 C-N-CA 125.244 1.418 . . . . 0.0 114.467 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.27 -31.92 54.91 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 171.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -87.4 -49.71 7.05 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.744 -1.222 . . . . 0.0 110.223 168.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -93.79 -10.79 33.0 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -152.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.8 t -57.64 -56.02 27.27 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.616 -1.302 . . . . 0.0 114.36 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.26 1.644 0 O-C-N 121.467 -0.77 . . . . 0.0 108.976 172.759 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.425 HG23 ' HB3' ' A' ' 4' ' ' LEU . 2.3 m . . . . . 0 CA--C 1.491 -1.314 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -71.85 -23.82 61.59 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.537 2.735 . . . . 0.0 113.989 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -72.6 -46.89 52.0 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.436 -1.415 . . . . 0.0 112.138 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.425 ' HB3' HG23 ' A' ' 1' ' ' VAL . 62.8 tp -61.87 -43.43 98.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.33 1.452 . . . . 0.0 111.303 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 31.7 t80 -44.44 -48.85 9.97 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.748 2.019 . . . . 0.0 112.585 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -83.41 -27.4 29.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.945 -1.097 . . . . 0.0 112.961 -176.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -61.7 -53.59 54.03 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.877 -1.139 . . . . 0.0 112.039 169.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -86.01 -21.54 27.74 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.017 -1.677 . . . . 0.0 114.579 -173.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.48 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -64.64 -47.47 78.41 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 124.351 2.024 . . . . 0.0 113.596 176.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -60.96 -22.04 64.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.628 1.971 . . . . 0.0 113.367 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.48 -58.37 3.33 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.27 1.028 . . . . 0.0 110.731 168.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 m -64.41 -26.69 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 119.972 -1.705 . . . . 0.0 114.241 -172.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -76.26 -11.01 59.84 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 175.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -128.13 -2.79 5.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.946 1.299 . . . . 0.0 112.593 -171.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.495 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 tp -68.46 150.5 97.67 Favored Pre-proline 0 N--CA 1.43 -1.432 0 O-C-N 119.327 -2.108 . . . . 0.0 111.713 -174.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.495 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 81.4 Cg_endo -74.79 -10.9 21.81 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.876 3.051 . . . . 0.0 112.182 -172.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 55.0 m -109.63 80.1 1.28 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 164.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -58.96 145.0 81.09 Favored Pre-proline 0 N--CA 1.429 -1.482 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.847 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -67.79 157.25 62.63 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.531 2.154 . . . . 0.0 113.904 -153.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 t -72.48 135.42 45.69 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.762 -1.212 . . . . 0.0 111.243 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.6 t -53.56 -36.89 62.35 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -68.01 -41.99 81.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.231 1.812 . . . . 0.0 112.912 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.58 -48.8 65.82 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.263 1.425 . . . . 0.0 110.12 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.0 tt -48.75 -37.8 19.95 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.754 2.422 . . . . 0.0 116.473 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.91 -57.94 6.44 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -67.71 -40.95 84.22 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.597 1.159 . . . . 0.0 111.159 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.09 -31.46 70.19 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.122 1.769 . . . . 0.0 113.247 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.66 -54.82 33.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.755 1.622 . . . . 0.0 108.724 168.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.21 -48.1 65.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 69' ' ' ALA . 0.4 OUTLIER -65.13 -46.43 81.01 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 174.307 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.48 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.4 t80 -55.88 -50.55 70.34 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.119 1.437 . . . . 0.0 111.051 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -64.23 -36.86 85.44 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.359 -1.463 . . . . 0.0 112.866 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -53.24 -60.07 3.76 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.883 1.219 . . . . 0.0 113.914 176.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -93.67 -0.29 56.14 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.0 113.668 -176.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.9 m -69.41 -64.34 0.89 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.278 -1.514 . . . . 0.0 111.502 161.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.84 -45.49 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.676 -1.265 . . . . 0.0 114.17 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 108.14 -31.53 7.83 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.084 -1.635 . . . . 0.0 113.69 -175.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.66 164.88 26.52 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.345 1.058 . . . . 0.0 108.799 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -48.32 103.61 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 157.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -92.36 -81.36 0.34 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.67 1.188 . . . . 0.0 111.046 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.7 81.7 8.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.002 1.721 . . . . 0.0 111.93 -171.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -83.26 64.76 7.92 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.907 1.813 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -159.26 68.42 3.21 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 127.187 2.195 . . . . 0.0 107.453 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.82 152.92 47.7 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.688 2.353 . . . . 0.0 107.554 158.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.47 -170.22 33.98 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.56 -1.962 . . . . 0.0 114.934 -168.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.3 pt -102.46 -47.11 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.651 -1.499 . . . . 0.0 109.513 -162.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -84.65 -7.64 59.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.95 2.1 . . . . 0.0 109.917 167.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -76.67 70.35 3.16 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.566 1.146 . . . . 0.0 113.216 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -58.18 -33.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.013 2.125 . . . . 0.0 113.958 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -66.52 -62.31 1.53 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.104 1.362 . . . . 0.0 111.717 175.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.68 -32.55 65.53 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -50.99 -50.71 57.8 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 169.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.286 17.1 p90 -74.02 -36.39 64.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.42 -1.425 . . . . 0.0 113.921 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -53.25 -50.24 65.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.739 1.216 . . . . 0.0 112.873 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -73.41 -33.75 65.12 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.083 0.953 . . . . 0.0 113.342 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -69.7 -38.09 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.02 -1.675 . . . . 0.0 111.914 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.98 -17.83 62.63 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.99 1.316 . . . . 0.0 112.974 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -88.89 -44.88 10.14 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.84 1.656 . . . . 0.0 109.103 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -57.41 -16.62 9.77 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.557 2.343 . . . . 0.0 113.681 175.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -67.08 -26.03 66.52 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.146 -2.846 . . . . 0.0 114.21 170.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -117.26 10.68 13.83 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.469 -1.394 . . . . 0.0 111.938 -175.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.84 -1.43 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.487 2 C-N-CA 134.904 5.282 . . . . 0.0 123.555 -172.256 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -168.5 4.91 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.734 0 O-C-N 119.491 -2.006 . . . . 0.0 111.803 173.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -106.77 -55.89 2.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.462 1.601 . . . . 0.0 108.178 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.5 m -86.53 34.15 0.64 Allowed 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.748 -1.569 . . . . 0.0 114.712 -161.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -55.01 -33.08 62.3 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.962 -1.712 . . . . 0.0 111.923 150.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.35 -49.01 37.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 129.678 3.191 . . . . 0.0 112.209 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -42.54 53.03 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.633 -0.667 . . . . 0.0 112.731 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -42.44 -62.38 0.98 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.52 -28.23 8.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 120.108 3.374 . . . . 0.0 120.108 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 mmtt -88.85 -38.76 14.34 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.912 2.085 . . . . 0.0 113.386 179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.46 -23.5 24.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.318 -1.489 . . . . 0.0 111.265 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.435 ' CE2' HG21 ' A' ' 77' ' ' VAL . 18.6 t80 -65.61 -48.5 72.08 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.239 -1.538 . . . . 0.0 113.82 -176.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.9 tt -38.79 -54.26 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 167.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.01 -18.14 58.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.3 mt -76.71 -53.58 7.79 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.822 -1.799 . . . . 0.0 110.447 168.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 73' ' ' TYR . 40.9 t -69.53 -26.79 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.611 1.964 . . . . 0.0 112.017 -168.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.31 -38.15 90.02 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 0.0 112.913 170.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -80.29 -16.04 55.56 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.379 1.071 . . . . 0.0 113.22 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.76 -62.2 1.48 Allowed 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.686 . . . . 0.0 107.941 164.496 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.27 -33.0 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 125.346 1.458 . . . . 0.0 113.517 -173.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.36 59.85 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -86.96 -45.41 10.82 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.92 -1.113 . . . . 0.0 110.436 169.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.5 m-30 -90.36 -12.79 36.6 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -153.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.4 p -43.98 -54.84 5.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.1 p . . . . . 0 C--O 1.26 1.63 0 O-C-N 120.888 -1.132 . . . . 0.0 110.755 170.14 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.711 0.767 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -73.93 -18.58 60.88 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.825 -1.797 . . . . 0.0 113.408 -174.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -78.72 -45.94 20.09 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.858 -1.776 . . . . 0.0 112.266 171.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.4 tp -63.24 -37.03 85.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.691 -1.256 . . . . 0.0 110.645 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.59 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 73.9 t80 -44.24 -46.69 9.14 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.906 1.682 . . . . 0.0 112.276 172.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.09 -41.86 21.88 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.868 -1.145 . . . . 0.0 111.946 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.8 -46.31 78.03 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.672 1.189 . . . . 0.0 112.907 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -88.34 -28.02 21.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -178.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.4 -48.09 68.37 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.307 -2.12 . . . . 0.0 113.552 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.03 -15.8 63.95 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.112 0.965 . . . . 0.0 113.39 173.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.4 -54.21 8.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.121 -0.987 . . . . 0.0 111.265 166.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.512 ' HA ' HD22 ' A' ' 15' ' ' LEU . 26.8 m -68.23 -33.04 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.741 1.216 . . . . 0.0 113.699 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -77.64 -6.22 53.06 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.9 -1.125 . . . . 0.0 113.544 176.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -121.35 2.38 10.26 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.552 1.141 . . . . 0.0 112.642 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 84' ' ' TYR . 1.7 tp -71.45 156.18 91.82 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 119.398 -2.064 . . . . 0.0 112.18 -167.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 84.6 Cg_endo -75.26 -21.49 15.32 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.981 2.458 . . . . 0.0 111.017 -177.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.5 m -96.22 63.15 2.19 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -51.53 144.32 17.73 Favored Pre-proline 0 N--CA 1.429 -1.505 0 C-N-CA 127.856 2.462 . . . . 0.0 114.163 -170.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -59.21 136.76 74.74 Favored 'Trans proline' 0 N--CA 1.434 -2.022 0 CA-C-N 124.426 2.616 . . . . 0.0 118.228 -153.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 m -77.61 147.64 35.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.902 1.281 . . . . 0.0 111.95 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.26 12.3 t -62.1 -45.79 91.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 -158.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.68 -28.4 60.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.76 -1.837 . . . . 0.0 112.717 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.81 -44.14 33.72 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.713 1.605 . . . . 0.0 110.979 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -47.75 -38.78 16.22 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.999 2.52 . . . . 0.0 116.068 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.9 -45.12 87.29 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -66.79 -44.95 79.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.696 1.199 . . . . 0.0 110.399 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.76 -42.34 97.26 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.286 2.234 . . . . 0.0 113.539 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -49.58 -55.48 13.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.826 2.45 . . . . 0.0 111.716 171.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.47 -50.29 32.09 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 178.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 69' ' ' ALA . 2.7 mm? -77.4 -38.72 49.26 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -177.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.46 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 26.0 t80 -61.31 -56.31 21.91 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.866 -1.771 . . . . 0.0 111.299 175.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.445 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.5 mmmt -57.66 -40.12 78.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.523 -1.986 . . . . 0.0 112.816 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.435 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . 20.8 mt-30 -46.15 -61.57 1.71 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 171.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -85.44 -14.64 45.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.783 -1.198 . . . . 0.0 112.718 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.0 m -60.3 -60.26 4.1 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.227 0.922 . . . . 0.0 112.188 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.06 -47.16 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.905 -1.122 . . . . 0.0 113.104 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.85 4.83 45.17 Favored Glycine 0 N--CA 1.43 -1.731 0 O-C-N 121.105 -0.997 . . . . 0.0 114.607 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -144.51 169.09 18.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -72.94 88.59 1.37 Allowed 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.185 1.469 . . . . 0.0 112.641 158.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -72.83 -75.54 0.14 Allowed 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.199 -1.563 . . . . 0.0 113.862 -175.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.6 ttmm -86.45 81.39 8.33 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 -150.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -81.45 36.81 0.44 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.926 2.09 . . . . 0.0 112.046 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.08 71.27 75.73 Favored Pre-proline 0 N--CA 1.43 -1.442 0 C-N-CA 126.411 1.885 . . . . 0.0 108.84 166.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -84.25 -158.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 123.191 2.594 . . . . 0.0 111.273 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.37 -178.53 47.91 Favored Glycine 0 N--CA 1.429 -1.81 0 CA-C-N 121.881 2.128 . . . . 0.0 114.561 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.5 pt -105.28 -47.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 121.44 -1.035 . . . . 0.0 109.284 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.89 33.32 4.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.369 1.868 . . . . 0.0 110.617 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -82.71 146.35 29.09 Favored 'General case' 0 N--CA 1.429 -1.504 0 O-C-N 119.177 -2.202 . . . . 0.0 110.388 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.2 tpt -98.67 -35.58 10.14 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.175 -1.578 . . . . 0.0 108.998 170.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -74.34 -31.89 62.59 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -175.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -35.1 76.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.898 -1.751 . . . . 0.0 113.746 176.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.9 mmt85 -60.06 -21.1 60.99 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.294 2.238 . . . . 0.0 113.75 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -91.41 -58.76 2.34 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.956 163.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -55.11 -58.0 9.43 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.62 1.968 . . . . 0.0 115.845 -173.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -78.48 -27.22 46.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.191 -0.943 . . . . 0.0 110.453 -167.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -73.08 -35.68 66.68 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.049 -1.657 . . . . 0.0 112.256 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.76 -29.17 69.07 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.107 -0.996 . . . . 0.0 113.038 172.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.445 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.0 t90 -75.8 -52.95 9.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.162 1.385 . . . . 0.0 111.805 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -55.6 -29.46 59.16 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 131.091 3.756 . . . . 0.0 113.053 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -54.48 -40.7 68.72 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.785 1.234 . . . . 0.0 113.11 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.56 46.27 0.98 Allowed 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.639 1.209 . . . . 0.0 111.877 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.06 -47.13 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.436 1 N-CA-C 123.564 4.653 . . . . 0.0 123.564 167.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.87 -16.44 0.51 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 121.396 1.907 . . . . 0.0 113.113 -160.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -104.71 11.1 34.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.397 2.046 . . . . 0.0 110.289 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -46.11 -47.87 17.28 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 129.399 3.079 . . . . 0.0 116.188 -174.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.67 -16.94 60.75 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.369 -1.457 . . . . 0.0 114.133 -174.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -93.36 -38.72 11.32 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.688 1.595 . . . . 0.0 112.858 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -87.82 -40.24 14.19 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.778 -1.201 . . . . 0.0 111.251 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.697 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -54.94 -58.54 7.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -43.42 -27.69 0.29 Allowed 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 172.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -88.52 -39.56 14.08 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.707 2.003 . . . . 0.0 112.996 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.49 -21.74 48.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.594 -0.691 . . . . 0.0 111.571 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' CE2' HG21 ' A' ' 77' ' ' VAL . 16.7 t80 -68.28 -52.3 35.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.793 1.237 . . . . 0.0 112.09 -167.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.5 tt -40.28 -50.56 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 166.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.33 -30.14 63.15 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.7 mt -67.33 -53.51 28.9 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.872 -1.767 . . . . 0.0 111.577 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.5 HG13 HG11 ' A' ' 12' ' ' VAL . 24.3 t -74.53 -24.79 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 125.566 1.546 . . . . 0.0 111.172 -167.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.65 -30.54 71.26 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.419 -2.05 . . . . 0.0 112.873 170.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.52 -13.38 54.69 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.63 -1.294 . . . . 0.0 113.058 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.7 mp -78.25 -63.35 1.42 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.168 -1.583 . . . . 0.0 108.068 163.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.478 HD13 HD21 ' A' ' 15' ' ' LEU . 6.2 mm -50.85 -39.79 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 128.55 2.74 . . . . 0.0 114.467 -174.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.15 -34.23 65.95 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 172.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? -87.53 -38.66 15.82 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.257 -1.527 . . . . 0.0 112.29 166.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 15' ' ' LEU . 3.6 m-30 -91.83 -30.84 15.98 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.236 -1.54 . . . . 0.0 113.701 -156.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.0 p -35.01 -54.79 0.59 Allowed 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 C--O 1.26 1.611 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 171.512 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -75.21 -23.01 57.55 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.469 -2.019 . . . . 0.0 114.699 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -85.58 -44.62 12.48 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.594 -1.316 . . . . 0.0 109.753 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.9 tp -52.06 -45.74 64.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.849 2.86 . . . . 0.0 110.692 178.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 19.3 t80 -43.28 -49.2 6.79 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 128.603 2.761 . . . . 0.0 111.091 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -80.17 -39.46 29.26 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 121.161 -0.962 . . . . 0.0 112.767 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.48 -40.08 92.71 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.483 -1.386 . . . . 0.0 113.268 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -82.41 -27.63 31.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.496 1.118 . . . . 0.0 112.633 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.409 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -63.48 -45.25 91.59 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.64 -1.912 . . . . 0.0 114.428 173.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -61.29 -26.72 67.97 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.332 1.453 . . . . 0.0 112.828 174.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.09 -59.07 2.93 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 123.813 0.845 . . . . 0.0 110.592 170.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.8 m -61.38 -31.21 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 O-C-N 120.487 -1.383 . . . . 0.0 113.589 -169.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -70.78 -21.11 62.54 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -127.2 22.97 6.53 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.864 1.266 . . . . 0.0 112.224 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.5 mt -71.73 157.21 90.15 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 119.4 -2.063 . . . . 0.0 110.911 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.88 -24.13 13.4 Favored 'Trans proline' 0 C--N 1.299 -2.038 0 C-N-CA 123.166 2.578 . . . . 0.0 110.676 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.7 m -105.11 80.88 1.66 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 171.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -58.51 157.32 18.86 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 126.259 1.824 . . . . 0.0 114.356 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -68.31 149.02 75.23 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 122.869 2.379 . . . . 0.0 112.186 -171.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -71.38 145.07 49.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 120.022 1.283 . . . . 0.0 113.326 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 49.4 m -36.14 -59.95 0.58 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.138 3.375 . . . . 0.0 117.192 -168.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -84.36 -32.82 24.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.615 -1.303 . . . . 0.0 111.165 -173.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.41 -36.84 82.07 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.526 1.531 . . . . 0.0 111.032 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -50.53 -31.26 15.06 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 127.029 2.131 . . . . 0.0 115.255 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.53 -38.88 74.29 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.965 -1.709 . . . . 0.0 113.177 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -65.47 -46.1 81.12 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.589 1.185 . . . . 0.0 111.359 173.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.23 -34.52 78.21 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.235 1.414 . . . . 0.0 113.138 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -56.93 -59.69 4.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.311 1.844 . . . . 0.0 111.184 167.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.95 -44.39 60.45 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 69' ' ' ALA . 2.6 mp -66.91 -52.24 45.57 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.409 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 12.6 t80 -54.97 -52.28 63.55 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-O 124.054 1.883 . . . . 0.0 111.439 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.522 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.9 mmmt -61.58 -31.95 72.03 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.363 1.465 . . . . 0.0 113.016 172.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -63.52 -61.33 2.4 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.91 -1.743 . . . . 0.0 115.414 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.305 . . -84.26 0.13 50.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -179.372 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -74.68 -61.31 1.92 Allowed 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.748 -1.845 . . . . 0.0 112.185 155.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.418 HG11 ' HB2' ' A' ' 40' ' ' ASP . 46.9 t -77.68 -55.03 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.022 -1.674 . . . . 0.0 113.024 -172.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.97 -0.26 62.39 Favored Glycine 0 N--CA 1.432 -1.611 0 C-N-CA 127.132 2.301 . . . . 0.0 114.168 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -136.99 173.0 12.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 166.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HA ' ' CE2' ' A' ' 58' ' ' TRP . 35.3 p-10 -72.52 118.52 15.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.619 -1.301 . . . . 0.0 111.864 152.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' HB2' HG11 ' A' ' 36' ' ' VAL . 48.3 t0 -79.94 -81.04 0.12 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.106 -1.621 . . . . 0.0 113.42 -168.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -87.96 92.42 9.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.548 1.139 . . . . 0.0 112.326 -162.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -78.01 49.45 0.8 Allowed 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 124.187 1.946 . . . . 0.0 112.827 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 tttt -160.26 89.34 1.8 Allowed Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 127.026 2.13 . . . . 0.0 107.349 167.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.4 161.88 36.92 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.454 2.103 . . . . 0.0 108.953 159.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.41 166.53 54.73 Favored Glycine 0 N--CA 1.43 -1.719 0 CA-C-N 120.797 1.635 . . . . 0.0 114.24 -166.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.0 pt -84.81 -36.93 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 120.649 -1.501 . . . . 0.0 111.346 -152.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -111.11 24.64 12.65 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.387 2.275 . . . . 0.0 109.537 169.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -84.44 97.9 9.77 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.561 -1.337 . . . . 0.0 111.924 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -71.78 -11.44 60.82 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -174.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -92.32 -63.78 1.19 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.566 -1.334 . . . . 0.0 110.082 171.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.25 -30.44 71.49 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -165.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -55.63 -35.02 65.45 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 124.673 1.189 . . . . 0.0 114.11 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -82.26 -47.63 12.19 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.96 1.704 . . . . 0.0 110.658 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -57.34 -48.37 79.18 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.764 1.226 . . . . 0.0 112.688 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -70.51 -30.91 67.8 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.118 -0.989 . . . . 0.0 113.509 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -73.39 -34.95 65.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.685 -1.884 . . . . 0.0 112.002 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.93 72.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.253 -1.529 . . . . 0.0 112.958 171.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.522 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.8 t90 -67.91 -37.39 81.64 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.771 1.228 . . . . 0.0 112.496 173.473 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -24.28 67.18 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.121 2.168 . . . . 0.0 114.101 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -72.07 -20.97 61.58 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 118.752 -2.467 . . . . 0.0 113.04 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.0 mt -101.06 -0.57 36.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.527 1.131 . . . . 0.0 113.728 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -26.44 -25.1 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 2 N-CA-C 124.694 5.072 . . . . 0.0 124.694 -158.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -165.5 27.42 0.19 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 119.389 -2.069 . . . . 0.0 110.952 167.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -117.24 -52.68 2.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.173 0.987 . . . . 0.0 110.03 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.4 m -82.91 36.12 0.49 Allowed 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -164.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -73.72 -28.96 61.98 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 127.055 2.142 . . . . 0.0 108.728 163.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.25 -43.35 78.05 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 129.396 3.079 . . . . 0.0 111.154 175.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -80.39 -39.72 27.88 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 118.48 -0.771 . . . . 0.0 111.978 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -42.59 -61.88 1.12 Allowed 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 174.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -46.47 -47.92 19.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 118.729 2.863 . . . . 0.0 118.729 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -88.2 -29.35 20.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.773 -1.83 . . . . 0.0 113.978 -170.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -89.87 -22.29 22.12 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.596 -1.315 . . . . 0.0 110.594 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.488 ' CE2' HG21 ' A' ' 77' ' ' VAL . 24.7 t80 -67.74 -48.37 66.62 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.1 -51.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 167.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.44 -32.93 72.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.1 -49.86 68.34 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.873 -1.142 . . . . 0.0 112.452 171.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.488 HG21 ' CE2' ' A' ' 73' ' ' TYR . 43.8 t -71.96 -21.37 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 C-N-CA 125.617 1.567 . . . . 0.0 111.151 -171.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -62.63 -43.56 98.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.703 -1.873 . . . . 0.0 114.014 163.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.01 -15.56 62.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.316 1.446 . . . . 0.0 113.734 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 7.2 mp -81.94 -65.21 1.04 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.351 1.86 . . . . 0.0 109.953 170.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.0 mt -65.94 -29.66 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.557 -1.339 . . . . 0.0 112.863 -165.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.22 -37.82 49.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.719 -1.238 . . . . 0.0 114.292 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -87.56 -39.57 15.0 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.699 1.199 . . . . 0.0 111.38 174.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -98.92 -13.84 19.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -156.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.49 -54.37 44.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.261 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 109.959 173.082 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 115.335 1.606 . . . . 0.0 115.335 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 p -59.23 -30.69 68.43 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 128.94 2.896 . . . . 0.0 114.438 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -58.2 -37.69 75.28 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.77 -50.77 65.51 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 123.455 1.597 . . . . 0.0 111.552 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.6 OUTLIER -49.6 -36.61 24.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.962 2.505 . . . . 0.0 111.2 172.355 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -81.39 -26.36 35.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.639 -1.288 . . . . 0.0 113.359 -178.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -64.71 -53.11 52.42 Favored 'General case' 0 N--CA 1.428 -1.529 0 O-C-N 119.829 -1.794 . . . . 0.0 111.43 166.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -68.05 -43.48 78.57 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.037 2.135 . . . . 0.0 112.861 -171.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.479 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.76 -46.18 69.45 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 124.203 1.954 . . . . 0.0 113.524 -171.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt -65.87 -16.63 64.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.54 -1.664 . . . . 0.0 113.325 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.75 -55.76 5.06 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.158 0.89 . . . . 0.0 111.44 165.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG11 HG13 ' A' ' 77' ' ' VAL . 28.4 m -65.28 -25.9 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 119.854 -1.779 . . . . 0.0 114.035 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -72.73 -10.89 60.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -148.22 29.25 0.88 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.935 1.35 . . . . 0.0 112.996 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.453 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.7 tp -73.52 165.15 55.63 Favored Pre-proline 0 N--CA 1.429 -1.505 0 O-C-N 119.965 -1.709 . . . . 0.0 108.802 172.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.453 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 60.7 Cg_endo -74.56 -28.96 9.55 Favored 'Trans proline' 0 N--CA 1.433 -2.079 0 CA-C-N 124.718 2.721 . . . . 0.0 110.919 178.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.6 m -103.0 78.77 1.68 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 104.024 -2.584 . . . . 0.0 104.024 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -64.75 152.81 89.41 Favored Pre-proline 0 N--CA 1.43 -1.474 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -67.52 150.15 80.14 Favored 'Trans proline' 0 C--N 1.301 -1.964 0 C-N-CA 122.924 2.416 . . . . 0.0 114.009 -161.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 t -81.04 174.54 11.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.661 1.119 . . . . 0.0 113.86 -171.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -57.55 -55.82 29.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.123 1.769 . . . . 0.0 114.595 -170.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -67.84 -31.03 70.58 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.408 1.883 . . . . 0.0 113.005 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -71.7 -59.87 2.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.44 1.896 . . . . 0.0 110.451 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.5 tp -49.25 -27.08 3.41 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.794 2.438 . . . . 0.0 117.129 -177.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.2 mt -61.23 -58.36 8.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.507 -1.371 . . . . 0.0 114.307 167.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -74.6 -35.16 62.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.188 0.994 . . . . 0.0 112.275 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.54 -32.6 73.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.643 1.577 . . . . 0.0 112.268 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -60.71 -55.24 35.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.425 -1.422 . . . . 0.0 110.867 164.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.04 -54.23 26.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 124.632 1.173 . . . . 0.0 112.598 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mp -63.04 -41.09 99.42 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 174.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.479 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 34.1 t80 -61.53 -53.4 56.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.828 -1.17 . . . . 0.0 112.153 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -53.79 -41.66 67.48 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.465 -2.022 . . . . 0.0 112.647 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -54.98 -60.66 3.06 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 124.576 1.151 . . . . 0.0 113.689 178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -89.29 -6.84 56.43 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.058 -1.651 . . . . 0.0 112.986 -175.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -68.27 -67.38 0.47 Allowed 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.492 -1.38 . . . . 0.0 111.49 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.35 -27.33 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.822 -1.174 . . . . 0.0 113.898 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.16 -17.73 57.67 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.065 -1.647 . . . . 0.0 115.553 171.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -135.14 166.59 22.73 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -56.45 85.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 151.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -77.52 -67.4 0.72 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.684 1.994 . . . . 0.0 113.475 -167.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 158.32 18.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -131.96 17.16 4.65 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 124.791 2.234 . . . . 0.0 107.726 172.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 96.64 46.86 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 125.855 1.662 . . . . 0.0 108.435 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.0 -165.33 0.32 Allowed 'Trans proline' 0 C--N 1.3 -2.01 0 C-N-CA 122.744 2.296 . . . . 0.0 111.249 166.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.26 174.68 9.44 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 117.255 1.662 . . . . 0.0 117.255 -175.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.4 pt -86.66 -46.73 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.174 -1.78 . . . . 0.0 112.304 -167.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -85.47 -5.24 59.31 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.27 2.228 . . . . 0.0 111.848 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.298 34.3 p-10 -17.02 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 121.784 3.994 . . . . 0.0 121.784 -170.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.3 mtt -93.48 -54.92 3.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.7 -1.25 . . . . 0.0 107.785 163.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.9 mttm -72.47 -42.06 65.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.627 -1.296 . . . . 0.0 114.313 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -62.13 -34.37 76.23 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.26 -18.01 61.27 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.983 -1.698 . . . . 0.0 114.446 -176.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -76.44 -50.1 14.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.106 -0.996 . . . . 0.0 111.131 166.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.89 -51.04 68.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.439 1.496 . . . . 0.0 114.248 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -66.26 -36.74 83.79 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.516 1.126 . . . . 0.0 112.681 -178.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -74.03 -32.38 63.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.522 -1.986 . . . . 0.0 112.434 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -25.68 67.3 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.108 -1.62 . . . . 0.0 112.793 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -80.07 -49.34 11.9 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.964 2.506 . . . . 0.0 110.223 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -12.48 40.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.713 2.005 . . . . 0.0 114.181 -179.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -72.09 -21.58 61.48 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.625 -1.922 . . . . 0.0 113.846 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 mp -114.92 14.69 17.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.86 -1.15 . . . . 0.0 113.207 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.94 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 1 N-CA-C 122.997 4.443 . . . . 0.0 122.997 177.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -102.36 -47.83 1.38 Allowed Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 126.274 1.892 . . . . 0.0 112.366 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -86.96 -6.11 58.87 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.819 -1.401 . . . . 0.0 113.401 -170.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 m -28.04 -61.44 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 129.468 3.107 . . . . 0.0 118.47 -175.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.4 -14.56 63.03 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -92.52 -44.56 8.57 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.703 1.201 . . . . 0.0 110.239 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -36.15 12.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -167.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -59.17 -53.12 61.95 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -41.08 -39.64 1.29 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 119.352 3.093 . . . . 0.0 119.352 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.5 mttp -88.25 -34.96 17.56 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.824 -1.797 . . . . 0.0 113.835 -176.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -77.53 -29.41 52.31 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.84 -1.162 . . . . 0.0 110.972 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.405 ' CE2' HG21 ' A' ' 77' ' ' VAL . 43.4 t80 -66.83 -45.93 76.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.383 -1.448 . . . . 0.0 113.959 -173.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.5 tp -47.11 -45.83 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.05 -39.87 87.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.35 -42.63 96.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.454 1.102 . . . . 0.0 113.099 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.559 HG13 HG11 ' A' ' 12' ' ' VAL . 49.8 t -77.32 -23.98 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.531 1.532 . . . . 0.0 111.096 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -63.36 -42.35 98.89 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.32 -2.113 . . . . 0.0 112.068 168.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -65.51 -26.97 68.14 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.356 1.463 . . . . 0.0 113.855 173.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mt -72.46 -63.1 1.22 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.219 1.408 . . . . 0.0 109.294 171.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.0 mt -64.45 -31.03 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.539 1.536 . . . . 0.0 113.185 -169.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.74 -30.01 60.5 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 170.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -87.65 -48.32 7.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.045 -1.035 . . . . 0.0 110.989 165.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -95.0 -12.23 27.03 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -149.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -46.31 -54.72 8.42 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.961 1.704 . . . . 0.0 114.523 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.26 1.614 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 166.303 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.322 12.1 m . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -64.92 -23.38 67.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.326 2.33 . . . . 0.0 114.967 -171.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -77.88 -43.4 30.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.44 -1.413 . . . . 0.0 112.339 173.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.36 -44.06 95.95 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.83 1.652 . . . . 0.0 110.725 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.471 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 16.2 t80 -44.06 -40.01 4.57 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 128.074 2.55 . . . . 0.0 112.496 174.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -74.92 -46.05 38.43 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.092 -1.005 . . . . 0.0 111.71 178.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -58.49 -40.21 82.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.365 1.079 . . . . 0.0 113.858 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HB3' HG11 ' A' ' 77' ' ' VAL . 27.6 mmtt -65.89 -50.71 63.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.023 2.529 . . . . 0.0 112.299 172.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.33 -49.89 57.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 124.274 1.988 . . . . 0.0 114.531 -167.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -65.99 -14.79 62.26 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 113.185 -1.825 . . . . 0.0 113.789 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.27 -60.36 2.33 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 110.668 161.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.554 HG11 HG13 ' A' ' 77' ' ' VAL . 24.0 m -65.83 -28.84 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 120.069 -1.645 . . . . 0.0 114.929 -168.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.93 -14.49 60.25 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.075 -1.016 . . . . 0.0 113.026 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -106.53 -32.78 7.92 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.589 1.955 . . . . 0.0 113.538 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.32 154.95 0.59 Allowed Pre-proline 0 N--CA 1.43 -1.425 0 C-N-CA 129.787 3.235 . . . . 0.0 116.464 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.16 -14.95 20.64 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.847 2.365 . . . . 0.0 111.874 -174.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 56.1 m -111.79 76.3 0.97 Allowed 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.091 -2.929 . . . . 0.0 103.091 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -57.56 144.19 73.1 Favored Pre-proline 0 N--CA 1.431 -1.424 0 C-N-CA 124.444 1.098 . . . . 0.0 113.72 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -65.31 140.63 65.0 Favored 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 122.987 2.458 . . . . 0.0 112.811 -157.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.3 m -65.72 153.96 40.28 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 120.606 1.548 . . . . 0.0 113.804 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.4 m -40.93 -56.8 2.15 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 128.34 2.656 . . . . 0.0 116.805 -168.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.6 -33.38 66.67 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.926 1.69 . . . . 0.0 113.342 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -76.37 -46.78 25.89 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.714 1.606 . . . . 0.0 110.191 -175.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.1 tp -44.42 -38.22 3.9 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.251 2.221 . . . . 0.0 115.991 172.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -42.59 57.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -176.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.28 -26.7 58.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.314 -1.491 . . . . 0.0 111.231 176.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -72.06 -37.79 69.58 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.591 -1.318 . . . . 0.0 112.865 171.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -54.15 -51.99 62.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.023 1.729 . . . . 0.0 111.83 168.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.96 -49.06 51.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -67.6 -46.79 71.58 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 35.0 t80 -54.69 -53.04 60.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.249 1.5 . . . . 0.0 111.186 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.428 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 24.9 mmmt -64.99 -29.94 70.9 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 118.77 -2.456 . . . . 0.0 112.805 176.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -64.03 -53.18 54.01 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -86.29 -11.01 53.4 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.623 -1.923 . . . . 0.0 112.552 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 m -69.26 -53.77 18.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.485 -1.384 . . . . 0.0 112.179 166.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 38' ' ' ASP . 46.3 t -86.82 -62.05 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 O-C-N 120.631 -1.293 . . . . 0.0 112.708 -178.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.3 -26.62 10.96 Favored Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 128.346 2.879 . . . . 0.0 112.153 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' H ' HG12 ' A' ' 36' ' ' VAL . 5.4 m-20 -119.09 -176.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 170.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -67.51 123.29 20.0 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.745 -1.847 . . . . 0.0 110.792 146.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -80.96 -62.15 1.75 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.796 -1.815 . . . . 0.0 110.438 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -83.55 166.01 18.6 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -143.06 43.4 1.56 Allowed 'General case' 0 N--CA 1.43 -1.425 0 CA-C-O 124.08 1.895 . . . . 0.0 105.938 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -149.9 86.18 5.38 Favored Pre-proline 0 N--CA 1.429 -1.48 0 O-C-N 120.712 -1.243 . . . . 0.0 110.41 174.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.58 179.29 5.72 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.336 2.024 . . . . 0.0 109.548 155.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.92 -173.8 38.88 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.809 -1.807 . . . . 0.0 113.951 -173.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 pt -96.6 -50.42 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.962 -1.316 . . . . 0.0 108.954 -168.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -101.12 4.69 42.36 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.313 1.445 . . . . 0.0 110.674 168.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.51 83.28 3.2 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.878 -1.139 . . . . 0.0 112.516 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.3 tpt -64.24 -38.74 92.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.259 -1.526 . . . . 0.0 112.748 -172.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -65.14 -49.47 69.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.322 1.449 . . . . 0.0 113.518 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -62.13 -42.62 99.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.347 -1.471 . . . . 0.0 111.903 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp85 -56.92 -46.9 81.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 177.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.298 8.3 p90 -71.5 -35.95 70.93 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.707 1.594 . . . . 0.0 114.408 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -62.77 -45.72 91.37 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.652 -1.28 . . . . 0.0 112.029 173.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -66.0 -31.28 72.09 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.574 1.15 . . . . 0.0 113.037 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.92 -34.42 75.35 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.702 -1.874 . . . . 0.0 111.926 176.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -23.71 61.06 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.205 -1.56 . . . . 0.0 113.88 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.428 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 16.3 t90 -82.66 -43.88 16.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.124 1.37 . . . . 0.0 111.333 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -21.42 66.58 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.657 -1.277 . . . . 0.0 113.692 -178.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.24 -31.17 63.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.483 -1.386 . . . . 0.0 113.463 166.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.7 -0.13 25.77 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.476 1.11 . . . . 0.0 113.913 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -30.73 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.411 2 N-CA-C 125.446 5.35 . . . . 0.0 125.446 -162.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.61 15.93 0.19 Allowed Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 122.04 2.2 . . . . 0.0 114.479 169.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -116.82 -52.18 2.55 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 119.545 1.673 . . . . 0.0 110.867 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.7 m -85.78 43.44 1.04 Allowed 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -161.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.15 -33.56 65.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.793 1.637 . . . . 0.0 107.648 155.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.09 -37.35 84.74 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.955 2.902 . . . . 0.0 110.809 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -86.84 -45.68 10.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.018 1.327 . . . . 0.0 111.284 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.15 -61.39 1.33 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -49.69 -37.4 28.7 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 119.525 3.158 . . . . 0.0 119.525 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -88.47 -31.43 18.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.502 -1.999 . . . . 0.0 114.99 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -83.62 -25.8 30.51 Favored 'General case' 0 N--CA 1.428 -1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.404 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -66.25 -46.53 76.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -42.69 -52.75 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 170.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.69 -25.45 62.11 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.83 -51.83 24.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.787 -1.195 . . . . 0.0 110.983 170.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.599 HG11 ' HB3' ' A' ' 8' ' ' LYS . 77.9 t -70.62 -26.91 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.806 1.242 . . . . 0.0 111.597 -169.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -55.01 -42.13 72.17 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.475 -1.391 . . . . 0.0 113.379 167.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -78.77 -26.06 44.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.806 1.242 . . . . 0.0 114.135 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 6.7 mp -67.18 -56.37 10.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.386 1.474 . . . . 0.0 109.421 170.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -66.64 -31.21 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.829 -1.17 . . . . 0.0 112.479 -171.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.67 -34.44 38.27 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 168.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -86.9 -47.67 8.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.496 -1.377 . . . . 0.0 109.517 171.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -93.58 -11.88 30.77 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -151.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -48.35 -54.48 13.74 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.26 1.611 0 C-N-CA 123.556 0.742 . . . . 0.0 110.711 172.073 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 4' ' ' LEU . 2.4 p . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 122.209 1.004 . . . . 0.0 112.644 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -74.99 -26.52 59.62 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.997 2.119 . . . . 0.0 113.468 -171.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -66.55 -49.15 67.39 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 118.988 -2.32 . . . . 0.0 112.911 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 1' ' ' VAL . 56.4 tp -60.17 -43.7 95.62 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.923 1.689 . . . . 0.0 111.82 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.545 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -44.14 -52.18 7.48 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.534 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -87.99 -28.74 21.24 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.145 -0.972 . . . . 0.0 111.2 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -54.53 -46.46 73.57 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 119.461 1.028 . . . . 0.0 113.581 171.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -89.01 -20.39 24.47 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.476 -1.39 . . . . 0.0 114.352 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.237 -2.164 . . . . 0.0 113.071 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.84 -17.15 64.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.787 171.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.05 -60.07 2.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.467 -1.396 . . . . 0.0 110.032 167.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.431 HG11 HG13 ' A' ' 77' ' ' VAL . 35.5 m -62.57 -29.56 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.491 -1.381 . . . . 0.0 113.798 -169.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -82.19 -1.42 49.02 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.765 -1.209 . . . . 0.0 113.608 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -129.42 5.93 5.23 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.985 1.714 . . . . 0.0 112.87 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.423 HD11 HD13 ' A' ' 81' ' ' ILE . 14.2 mt -69.56 159.68 82.65 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 118.421 -2.674 . . . . 0.0 113.168 -175.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.62 -22.05 9.49 Favored 'Trans proline' 0 N--CA 1.434 -2.028 0 C-N-CA 122.82 2.347 . . . . 0.0 111.188 175.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -101.65 81.96 2.22 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 103.512 -2.773 . . . . 0.0 103.512 174.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 61.1 mttm -64.92 155.88 81.83 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 66.7 Cg_exo -67.93 153.05 76.31 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 C-N-CA 122.023 1.815 . . . . 0.0 114.872 -163.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -82.15 145.16 30.26 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.4 m -53.41 -51.45 62.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 -166.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -80.32 -12.84 59.56 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.867 -1.77 . . . . 0.0 113.881 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -85.38 -45.95 11.4 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.204 1.001 . . . . 0.0 109.699 171.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -44.28 -38.41 3.84 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.775 2.83 . . . . 0.0 117.407 176.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -49.97 -55.69 13.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 168.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.59 -31.11 36.83 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.924 0.89 . . . . 0.0 112.788 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.52 -31.74 70.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.961 -1.712 . . . . 0.0 112.673 174.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -58.5 -56.94 15.68 Favored 'General case' 0 N--CA 1.431 -1.378 0 O-C-N 120.317 -1.489 . . . . 0.0 110.151 161.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.91 -54.89 13.53 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.25 1.42 . . . . 0.0 113.613 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.07 -37.08 86.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 176.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.428 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 27.1 t80 -60.99 -53.39 57.86 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.625 1.203 . . . . 0.0 111.066 176.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.6 mmmt -54.96 -40.75 70.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 127.212 2.205 . . . . 0.0 113.426 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -57.92 -61.08 2.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.784 -1.197 . . . . 0.0 113.112 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.545 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -82.43 -8.3 59.62 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . 0.257 1.3 p -68.19 -55.79 11.04 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.875 2.125 . . . . 0.0 111.722 165.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.5 p -87.23 -69.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 120.435 -1.415 . . . . 0.0 113.153 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.98 9.77 8.68 Favored Glycine 0 N--CA 1.431 -1.697 0 O-C-N 120.699 -1.25 . . . . 0.0 114.927 -173.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -140.27 164.89 28.88 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 169.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -70.84 83.3 0.65 Allowed 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.512 -1.367 . . . . 0.0 111.643 149.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -82.1 -54.53 5.21 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.733 -1.854 . . . . 0.0 114.393 -158.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -84.79 82.32 8.49 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.519 -1.363 . . . . 0.0 114.643 -171.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -81.3 46.5 0.94 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.759 -1.838 . . . . 0.0 114.469 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -160.01 91.0 1.78 Allowed Pre-proline 0 N--CA 1.43 -1.436 0 C-N-CA 126.911 2.084 . . . . 0.0 107.361 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.93 166.95 28.04 Favored 'Trans proline' 0 C--N 1.3 -2.025 0 C-N-CA 122.453 2.102 . . . . 0.0 112.787 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.9 -159.95 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.762 1 N-CA-C 123.346 4.098 . . . . 0.0 123.346 -153.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 20.3 pt -90.57 -43.86 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.05 -1.853 . . . . 0.0 113.271 -156.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -88.39 -24.48 23.06 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.67 1.988 . . . . 0.0 110.741 174.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.401 26.2 p-10 5.79 87.12 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 131.507 3.923 . . . . 0.0 121.161 -173.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 60.7 mtt -98.98 -59.74 1.67 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 167.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -84.27 -29.35 26.51 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.302 1.441 . . . . 0.0 113.32 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.28 -23.05 66.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.673 1.989 . . . . 0.0 114.074 -173.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -55.81 -40.15 72.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.873 2.069 . . . . 0.0 113.363 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.5 -33.76 15.82 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.695 1.598 . . . . 0.0 110.947 -174.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.63 -51.9 52.06 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 125.624 1.57 . . . . 0.0 112.717 164.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -31.86 70.65 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.874 -1.142 . . . . 0.0 113.568 -179.209 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -67.44 -36.13 80.61 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.001 -1.687 . . . . 0.0 112.304 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.7 -28.15 66.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.544 1.137 . . . . 0.0 112.448 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.408 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 10.1 t90 -79.65 -43.67 22.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 126.608 1.963 . . . . 0.0 110.57 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -31.46 63.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.882 2.073 . . . . 0.0 113.802 175.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -52.34 -35.32 50.7 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.694 -1.879 . . . . 0.0 114.198 170.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.6 mp -113.73 31.9 6.2 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.968 0.89 . . . . 0.0 113.368 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -26.15 -50.58 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.463 1 N-CA-C 122.321 4.193 . . . . 0.0 122.321 172.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.29 -17.46 1.98 Allowed Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 119.469 1.032 . . . . 0.0 114.871 -168.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -96.41 -5.07 40.62 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 119.273 1.537 . . . . 0.0 111.459 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.3 p -26.71 -70.48 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 131.103 3.761 . . . . 0.0 117.219 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -53.84 -38.3 64.5 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -166.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -92.35 -21.03 20.48 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.087 1.355 . . . . 0.0 112.931 -177.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.48 -39.07 12.16 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.477 -2.015 . . . . 0.0 110.195 177.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -46.87 -62.03 1.58 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.674 1.989 . . . . 0.0 113.482 173.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.19 -33.99 21.19 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 119.283 3.068 . . . . 0.0 119.283 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -88.55 -28.69 20.59 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.217 1.807 . . . . 0.0 114.422 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -88.44 -26.86 21.89 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.899 -1.751 . . . . 0.0 111.99 174.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.486 ' CE2' HG21 ' A' ' 77' ' ' VAL . 28.0 t80 -66.74 -46.72 74.54 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 120.173 -1.58 . . . . 0.0 112.388 -174.227 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 tt -39.12 -51.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 166.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.21 -26.5 59.01 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -174.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.2 mt -75.96 -53.08 8.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.017 -1.052 . . . . 0.0 110.313 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.486 HG21 ' CE2' ' A' ' 73' ' ' TYR . 41.9 t -68.46 -22.23 26.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.52 1.928 . . . . 0.0 111.168 -171.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.01 -35.25 80.1 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.58 -1.95 . . . . 0.0 113.683 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -83.66 -16.29 45.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.344 1.458 . . . . 0.0 112.666 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -73.23 -65.01 0.86 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.645 -1.285 . . . . 0.0 108.325 163.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 15' ' ' LEU . 3.9 mm -57.07 -40.86 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.639 1.976 . . . . 0.0 113.969 -170.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -30.5 66.83 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -86.93 -44.7 11.44 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.043 -1.036 . . . . 0.0 109.07 170.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -94.86 -26.63 16.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -152.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.5 t -40.92 -54.69 2.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.613 1.965 . . . . 0.0 115.88 -175.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.261 1.704 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 166.534 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 84.8 t . . . . . 0 CA--C 1.49 -1.329 0 CA-C-O 122.364 1.078 . . . . 0.0 113.449 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -86.53 0.87 53.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 130.564 3.545 . . . . 0.0 114.819 -174.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -67.4 -56.29 10.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.307 -2.12 . . . . 0.0 111.585 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.616 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -62.0 -27.95 69.23 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 128.14 2.576 . . . . 0.0 112.558 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 39.7 t80 -56.97 -55.43 34.75 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.564 1.146 . . . . 0.0 110.789 169.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -79.15 -14.09 59.32 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 119.713 -1.867 . . . . 0.0 113.446 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -66.07 -63.08 1.16 Allowed 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.533 1.635 . . . . 0.0 111.09 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -89.4 -17.0 29.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 113.944 -1.48 . . . . 0.0 113.924 -166.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -71.3 -39.8 71.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 121.095 1.77 . . . . 0.0 112.143 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -40.08 63.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.756 2.022 . . . . 0.0 112.615 170.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.7 -56.64 5.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.614 1.165 . . . . 0.0 110.844 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.458 HG21 HD21 ' A' ' 27' ' ' LEU . 27.4 m -62.71 -27.22 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.263 -1.523 . . . . 0.0 114.347 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -69.94 -22.09 63.21 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.59 18.4 4.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.053 -1.029 . . . . 0.0 113.122 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.6 tp -71.76 156.62 90.94 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 120.12 -1.612 . . . . 0.0 109.614 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.466 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 94.5 Cg_endo -76.03 -20.58 14.77 Favored 'Trans proline' 0 C--N 1.299 -2.047 0 CA-C-N 123.356 2.234 . . . . 0.0 111.1 -174.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 50.8 m -106.03 76.49 1.17 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -62.09 150.62 83.25 Favored Pre-proline 0 N--CA 1.43 -1.445 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -172.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -66.3 150.8 84.48 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 C-N-CA 123.512 2.808 . . . . 0.0 113.187 -163.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -82.78 171.03 14.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 120.401 1.455 . . . . 0.0 113.944 -171.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.4 m -47.82 -57.9 5.04 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 129.999 3.32 . . . . 0.0 117.039 -168.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -83.77 -22.81 31.77 Favored 'General case' 0 CA--C 1.489 -1.376 0 O-C-N 120.784 -1.197 . . . . 0.0 112.449 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -69.76 -40.77 75.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.401 1.481 . . . . 0.0 110.491 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.2 -53.22 5.2 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.283 3.033 . . . . 0.0 114.575 175.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.03 -46.92 72.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.267 2.227 . . . . 0.0 115.248 176.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.03 -44.27 76.84 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.516 -1.365 . . . . 0.0 111.918 172.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.458 HD21 HG21 ' A' ' 12' ' ' VAL . 2.1 tm? -62.9 -45.37 92.82 Favored 'General case' 0 N--CA 1.431 -1.38 0 C-N-CA 127.406 2.283 . . . . 0.0 113.59 -174.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -59.32 -57.12 14.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.832 2.053 . . . . 0.0 110.575 167.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.86 -46.74 71.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.297 1.039 . . . . 0.0 113.742 -172.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -72.95 -39.82 65.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.566 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 17.4 t80 -57.62 -55.13 38.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.783 1.278 . . . . 0.0 110.839 176.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -60.14 -31.48 70.12 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.216 -1.553 . . . . 0.0 113.654 172.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 22.3 mt-30 -57.99 -61.64 2.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.05 -1.656 . . . . 0.0 115.349 174.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.48 -9.83 48.61 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 119.184 -1.007 . . . . 0.0 112.771 -174.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 97.2 m -71.42 -52.38 18.87 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.715 -1.241 . . . . 0.0 111.211 168.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.422 HG11 ' CB ' ' A' ' 40' ' ' ASP . 2.0 t -84.94 -54.06 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 120.178 -1.576 . . . . 0.0 111.34 -178.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.32 8.86 Favored Glycine 0 N--CA 1.429 -1.802 0 O-C-N 121.016 -1.052 . . . . 0.0 115.162 168.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -135.37 175.62 9.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 104.267 -2.494 . . . . 0.0 104.267 166.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -66.36 97.79 0.43 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.692 -1.255 . . . . 0.0 113.377 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.422 ' CB ' HG11 ' A' ' 36' ' ' VAL . 7.7 t70 -85.32 -65.71 0.98 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 119.666 -1.896 . . . . 0.0 114.42 -166.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -85.19 81.86 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.214 -1.554 . . . . 0.0 115.108 -164.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -78.76 48.31 0.81 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 123.874 1.797 . . . . 0.0 113.3 -174.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.8 pttt -160.22 87.35 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.439 0 C-N-CA 128.198 2.599 . . . . 0.0 110.037 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.35 -177.74 3.21 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 123.283 2.656 . . . . 0.0 111.598 164.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -74.46 -175.11 33.38 Favored Glycine 0 N--CA 1.429 -1.785 0 CA-C-N 120.836 1.653 . . . . 0.0 117.041 -161.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.0 pt -94.4 -34.85 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.906 -1.349 . . . . 0.0 110.196 -163.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -117.18 5.07 12.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.692 1.197 . . . . 0.0 109.839 169.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -81.04 103.6 10.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -163.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.1 mtm -73.96 -40.28 63.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.69 -1.256 . . . . 0.0 111.502 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -68.11 -50.83 52.4 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.984 1.314 . . . . 0.0 113.543 -175.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -60.73 -35.33 76.09 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.674 -1.266 . . . . 0.0 113.745 175.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -57.6 -44.66 85.61 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.304 -1.497 . . . . 0.0 114.789 171.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -64.39 -49.68 70.66 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.513 -1.367 . . . . 0.0 112.092 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -56.17 -43.4 78.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.024 1.33 . . . . 0.0 114.077 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.29 -36.84 79.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -71.85 -27.19 62.72 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.742 -1.849 . . . . 0.0 112.26 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.03 -24.49 61.56 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.93 -1.731 . . . . 0.0 113.563 170.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.42 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 13.4 t90 -81.48 -47.87 12.59 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.208 1.803 . . . . 0.0 110.586 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.54 -10.28 50.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.196 1.799 . . . . 0.0 114.948 -178.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.5 -40.57 97.16 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.182 -0.949 . . . . 0.0 111.919 164.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.8 mp -108.69 41.11 1.65 Allowed 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 123.922 1.82 . . . . 0.0 110.292 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.03 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.51 1 N-CA-C 122.117 4.117 . . . . 0.0 122.117 166.281 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.87 -18.41 0.86 Allowed Glycine 0 N--CA 1.43 -1.711 0 CA-C-N 120.351 1.432 . . . . 0.0 114.23 -158.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -107.74 26.13 10.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 124.552 2.12 . . . . 0.0 111.162 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.9 m -55.13 -50.7 68.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 129.259 3.024 . . . . 0.0 115.59 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.11 -10.88 59.83 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.999 -1.688 . . . . 0.0 114.458 -175.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -91.14 -45.24 8.78 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 123.367 0.667 . . . . 0.0 110.63 172.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -92.69 -35.37 13.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.95 -61.98 1.96 Allowed 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 121.061 -1.024 . . . . 0.0 112.882 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -40.68 -40.52 1.31 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 119.662 3.208 . . . . 0.0 119.662 176.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -87.38 -36.2 17.91 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.638 -1.914 . . . . 0.0 114.227 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -82.5 -21.8 35.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.495 -1.378 . . . . 0.0 110.853 175.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.451 ' CE2' HG21 ' A' ' 77' ' ' VAL . 16.2 t80 -63.9 -52.36 60.28 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.853 -1.154 . . . . 0.0 113.98 -177.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -39.88 -50.25 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 169.831 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.91 -15.3 60.21 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.3 mt -75.09 -59.27 2.81 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 120.052 -1.655 . . . . 0.0 110.317 164.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.451 HG21 ' CE2' ' A' ' 73' ' ' TYR . 22.6 t -73.27 -28.99 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 127.25 2.22 . . . . 0.0 111.601 -164.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.99 -37.59 87.98 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.853 -1.779 . . . . 0.0 112.301 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -82.62 -12.67 57.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.787 1.235 . . . . 0.0 112.805 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.98 -61.75 1.74 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.121 1.368 . . . . 0.0 108.919 162.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.7 mm -53.87 -38.94 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 128.705 2.802 . . . . 0.0 114.288 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -48.77 -43.55 37.97 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.093 1.357 . . . . 0.0 114.082 171.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -86.56 -39.5 16.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.074 -1.016 . . . . 0.0 110.353 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -100.6 -20.38 15.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -155.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.6 t -43.05 -55.08 4.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.709 1.604 . . . . 0.0 115.125 177.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.261 1.672 0 O-C-N 121.595 -0.691 . . . . 0.0 109.439 168.807 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 CA--C 1.49 -1.334 0 CA-C-O 122.199 1.0 . . . . 0.0 112.903 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -71.09 -19.06 62.51 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.144 -2.222 . . . . 0.0 114.296 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.9 -34.93 69.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.477 -2.014 . . . . 0.0 112.393 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 tp -62.95 -46.5 87.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.703 1.601 . . . . 0.0 111.651 173.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 8.9 t80 -48.09 -48.14 33.8 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.198 1.799 . . . . 0.0 111.451 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -76.16 -38.24 56.91 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 112.168 -175.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.52 -51.44 62.83 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.59 1.556 . . . . 0.0 113.21 173.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -86.5 -25.31 25.18 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.525 -1.36 . . . . 0.0 114.629 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.489 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -62.73 -47.13 84.9 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 121.603 2.001 . . . . 0.0 113.619 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -64.99 -19.6 66.08 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.251 1.42 . . . . 0.0 114.548 174.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.78 -59.05 2.91 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.749 -1.219 . . . . 0.0 110.633 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.6 m -63.22 -28.56 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.69 1.596 . . . . 0.0 113.062 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -70.11 -19.69 63.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -134.64 30.76 3.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 CA-C-N 120.12 1.327 . . . . 0.0 112.322 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.12 155.91 91.02 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 119.613 -1.929 . . . . 0.0 112.067 173.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.72 -19.53 14.31 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 C-N-CA 123.538 2.826 . . . . 0.0 111.633 -172.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.1 m -109.81 76.09 0.97 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -55.7 156.82 8.52 Favored Pre-proline 0 N--CA 1.43 -1.447 0 C-N-CA 127.264 2.225 . . . . 0.0 116.455 -169.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -56.4 136.62 76.6 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 124.095 3.197 . . . . 0.0 115.895 -172.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.9 m -79.44 139.05 37.79 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.658 1.183 . . . . 0.0 111.556 -176.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.9 m -44.4 -47.97 9.81 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.37 2.668 . . . . 0.0 117.907 -167.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -83.55 -27.39 29.34 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.552 -1.343 . . . . 0.0 114.27 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.69 -35.07 58.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.653 1.581 . . . . 0.0 110.581 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -52.05 -35.33 46.97 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 129.202 3.001 . . . . 0.0 113.524 173.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.8 mt -64.03 -47.16 81.33 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.699 1.6 . . . . 0.0 114.298 176.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.17 -45.12 89.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 122.599 1.19 . . . . 0.0 112.458 173.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.84 -45.19 93.2 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.585 2.354 . . . . 0.0 112.606 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -48.59 -56.96 6.98 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.777 2.431 . . . . 0.0 112.318 168.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.3 -48.16 62.39 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 0.0 114.1 -175.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 69' ' ' ALA . 3.7 mm? -77.13 -39.5 49.06 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.489 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.9 t80 -58.19 -56.64 19.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.767 1.627 . . . . 0.0 111.748 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -60.32 -35.94 76.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.331 -1.48 . . . . 0.0 112.779 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.456 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 2.6 mt-30 -50.39 -62.2 1.73 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 174.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.06 -9.92 49.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 120.568 1.531 . . . . 0.0 113.042 -178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.7 m -60.93 -67.83 0.37 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 0.0 112.918 167.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . 0.265 11.8 m -87.78 -32.6 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.123 -1.611 . . . . 0.0 114.53 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.03 -37.25 3.71 Favored Glycine 0 N--CA 1.431 -1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 115.984 171.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -118.43 171.24 8.29 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 118.992 1.396 . . . . 0.0 108.279 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -66.44 87.76 0.12 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.149 -1.595 . . . . 0.0 113.278 155.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -80.68 -59.09 2.81 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.374 -2.079 . . . . 0.0 114.994 -161.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.06 83.45 7.76 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.029 -1.67 . . . . 0.0 113.087 -171.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -72.45 42.68 0.1 Allowed 'General case' 0 N--CA 1.431 -1.421 0 CA-C-O 124.266 1.984 . . . . 0.0 114.001 178.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -160.02 84.89 2.1 Favored Pre-proline 0 N--CA 1.43 -1.457 0 C-N-CA 127.168 2.187 . . . . 0.0 108.597 174.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.06 165.76 31.36 Favored 'Trans proline' 0 N--CA 1.434 -1.996 0 C-N-CA 122.586 2.191 . . . . 0.0 109.146 151.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.56 -162.92 18.69 Favored Glycine 0 N--CA 1.431 -1.684 0 CA-C-N 120.802 1.637 . . . . 0.0 115.699 -174.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.4 pt -99.31 -54.1 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 120.632 -1.51 . . . . 0.0 111.72 -162.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.96 7.25 41.17 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 126.921 2.088 . . . . 0.0 110.581 172.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -80.34 73.15 7.23 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.447 1.899 . . . . 0.0 113.837 -169.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.0 mmt -54.67 -48.26 72.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.141 1.776 . . . . 0.0 114.368 -177.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -58.91 -47.51 84.74 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.431 1.092 . . . . 0.0 113.24 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -66.56 -37.36 84.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.955 -1.091 . . . . 0.0 113.521 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -56.24 -41.01 75.04 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.564 -1.335 . . . . 0.0 114.44 171.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.47 -45.99 50.85 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.692 -1.255 . . . . 0.0 113.244 175.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -55.78 -50.63 69.94 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.931 1.292 . . . . 0.0 114.069 175.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 -29.32 65.05 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 113.241 -177.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.93 -38.12 69.9 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.831 -1.793 . . . . 0.0 112.568 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.83 -24.75 66.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.896 -1.128 . . . . 0.0 112.369 175.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.456 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 11.2 t90 -82.17 -46.27 14.0 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.279 1.831 . . . . 0.0 110.86 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -57.24 -24.13 52.66 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.65 2.38 . . . . 0.0 113.764 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -50.4 -41.64 52.42 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.422 -2.049 . . . . 0.0 112.78 168.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mp -116.96 42.77 2.43 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-O 123.534 1.635 . . . . 0.0 112.189 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -43.82 -41.54 5.09 Favored 'General case' 0 N--CA 1.431 -1.414 1 N-CA-C 122.263 4.171 . . . . 0.0 122.263 172.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -114.64 -40.77 0.9 Allowed Glycine 0 N--CA 1.431 -1.658 0 C-N-CA 123.652 0.644 . . . . 0.0 112.648 -169.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -110.87 72.56 0.79 Allowed 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 124.999 2.333 . . . . 0.0 108.144 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 12.5 t -86.81 -65.29 1.03 Allowed 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 111.124 -2.762 . . . . 0.0 111.427 178.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -74.6 -10.8 59.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -151.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -92.9 -26.5 17.59 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.029 2.132 . . . . 0.0 113.922 170.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.37 -47.85 6.69 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.926 -1.733 . . . . 0.0 110.851 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HA ' HD12 ' A' ' 30' ' ' LEU . . . -43.1 -59.58 1.99 Allowed 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.322 2.649 . . . . 0.0 113.682 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -40.85 -48.39 3.08 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.802 2.89 . . . . 0.0 118.802 168.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -88.41 -29.5 20.18 Favored 'General case' 0 N--CA 1.429 -1.52 0 O-C-N 119.607 -1.933 . . . . 0.0 112.531 -173.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.92 -29.97 64.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.574 -1.328 . . . . 0.0 111.862 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -70.85 -53.68 14.35 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.935 1.294 . . . . 0.0 113.512 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.99 -50.15 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.33 -36.67 68.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -175.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 pp -75.12 -46.16 36.28 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.22 -0.925 . . . . 0.0 112.607 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 t -62.19 -30.08 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.238 1.815 . . . . 0.0 111.347 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -58.75 -42.18 88.25 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.882 -1.761 . . . . 0.0 112.715 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -74.84 -27.78 60.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.683 1.193 . . . . 0.0 113.077 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.7 mt -68.58 -52.3 33.13 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.321 1.448 . . . . 0.0 110.298 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.67 -32.29 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 119.939 -1.725 . . . . 0.0 113.512 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.8 -32.47 65.72 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.176 -1.577 . . . . 0.0 114.765 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -87.41 -38.94 15.69 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.776 -1.202 . . . . 0.0 111.891 171.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -95.58 -7.36 38.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 -163.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.0 t -54.26 -60.42 3.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.188 -1.57 . . . . 0.0 113.372 166.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.259 1.564 0 C-N-CA 124.249 1.02 . . . . 0.0 108.979 168.688 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 123.044 1.402 . . . . 0.0 114.016 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -63.74 -29.77 70.95 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.045 2.538 . . . . 0.0 112.622 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -59.65 -43.52 93.86 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.784 -2.447 . . . . 0.0 115.474 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 41.8 tp -64.42 -42.71 95.9 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.463 -1.398 . . . . 0.0 111.09 176.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.554 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -51.02 -38.6 52.37 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.39 1.876 . . . . 0.0 111.367 176.667 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.43 -47.82 38.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.042 -1.036 . . . . 0.0 112.606 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -54.96 -41.44 71.13 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.949 1.7 . . . . 0.0 112.868 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HB3' HG11 ' A' ' 77' ' ' VAL . 29.0 mmtt -76.99 -45.34 27.71 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.661 1.184 . . . . 0.0 113.76 173.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.493 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.95 -41.23 74.81 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.103 -2.248 . . . . 0.0 114.839 -167.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -65.97 -15.74 63.27 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.671 1.188 . . . . 0.0 113.259 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.5 -56.69 4.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.712 1.205 . . . . 0.0 111.755 163.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 77' ' ' VAL . 6.9 m -63.08 -24.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 119.745 -1.847 . . . . 0.0 113.597 -170.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -70.14 -18.76 63.23 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -123.9 9.29 8.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -177.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -63.15 146.72 95.66 Favored Pre-proline 0 N--CA 1.431 -1.416 0 O-C-N 120.62 -1.3 . . . . 0.0 113.301 -171.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.77 -20.57 15.26 Favored 'Trans proline' 0 N--CA 1.434 -1.994 0 C-N-CA 123.506 2.804 . . . . 0.0 111.312 -168.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 53.7 m -113.41 75.27 0.91 Allowed 'General case' 0 N--CA 1.43 -1.472 1 N-CA-C 99.609 -4.219 . . . . 0.0 99.609 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.75 156.92 11.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -164.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -59.68 134.52 58.12 Favored 'Trans proline' 0 N--CA 1.434 -1.992 0 C-N-CA 123.621 2.881 . . . . 0.0 113.892 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.8 t -80.97 166.4 20.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.729 1.149 . . . . 0.0 112.843 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -51.59 -59.44 4.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 128.237 2.615 . . . . 0.0 117.343 -163.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -70.61 -26.97 63.74 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.913 -1.117 . . . . 0.0 112.548 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.87 -41.3 37.28 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.501 -1.374 . . . . 0.0 111.716 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.1 tp -46.64 -46.37 19.77 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 128.928 2.891 . . . . 0.0 115.544 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 54' ' ' LYS . 78.3 mt -48.04 -55.98 8.84 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.503 1.921 . . . . 0.0 114.922 170.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -72.95 -38.37 66.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.521 1.128 . . . . 0.0 112.178 -177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.462 HD11 HD22 ' A' ' 80' ' ' LEU . 6.7 mp -66.85 -36.06 81.47 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.31 -57.96 10.57 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.343 1.457 . . . . 0.0 110.764 165.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.59 -52.97 26.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.183 1.393 . . . . 0.0 113.597 -173.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.21 -40.55 86.45 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.493 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 29.1 t80 -57.06 -52.94 63.27 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.735 1.255 . . . . 0.0 110.933 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 58' ' ' TRP . 25.2 mmmt -57.81 -38.6 75.84 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.005 -2.309 . . . . 0.0 113.346 172.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -56.1 -57.71 11.03 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -89.44 -10.56 45.98 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 112.881 -175.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -64.48 -59.51 4.24 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.505 -1.372 . . . . 0.0 110.665 167.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.5 -60.97 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 O-C-N 120.821 -1.174 . . . . 0.0 112.784 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.79 -25.65 6.43 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 124.439 1.019 . . . . 0.0 113.544 -177.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -120.29 -177.85 3.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -66.9 124.7 23.7 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 118.768 -2.458 . . . . 0.0 112.915 147.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.09 -59.74 2.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.222 -1.549 . . . . 0.0 109.97 176.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mtmm -80.19 161.4 25.24 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.46 1.504 . . . . 0.0 109.132 174.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 55' ' ' TRP . 21.8 tt0 -141.98 20.27 2.12 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.029 1.871 . . . . 0.0 109.733 168.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.1 tttp -129.53 91.53 40.71 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.198 -1.564 . . . . 0.0 110.644 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -77.94 159.37 30.86 Favored 'Trans proline' 0 C--N 1.299 -2.051 0 C-N-CA 121.716 1.611 . . . . 0.0 108.534 146.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.32 -145.89 2.28 Favored Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 117.472 1.749 . . . . 0.0 117.472 -171.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 ' H ' ' A' ' 47' ' ' PHE . 5.0 pt -107.11 -75.1 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.479 -1.012 . . . . 0.0 109.514 -168.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.538 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -73.18 -5.63 40.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.145 1.778 . . . . 0.0 113.04 169.215 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -72.52 67.64 0.76 Allowed 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 127.121 2.169 . . . . 0.0 112.126 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.6 ptm -64.7 -32.35 73.98 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.816 1.646 . . . . 0.0 112.525 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -64.54 -47.55 78.39 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.481 -0.762 . . . . 0.0 112.419 175.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.06 -42.25 85.07 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.996 1.318 . . . . 0.0 112.288 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -53.71 -48.49 69.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -63.24 -48.31 78.77 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.712 -1.243 . . . . 0.0 112.749 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.425 ' HD3' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -50.61 -51.36 49.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 126.926 2.091 . . . . 0.0 113.706 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TRP . . . . . 0.465 ' CZ2' ' HA ' ' A' ' 42' ' ' GLU . 17.9 t90 -73.18 -33.93 65.7 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.918 1.687 . . . . 0.0 112.715 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.13 -34.41 76.3 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.742 -1.849 . . . . 0.0 111.837 177.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.91 65.3 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.985 -1.072 . . . . 0.0 113.118 173.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.413 ' CE2' ' HB3' ' A' ' 32' ' ' LYS . 13.9 t90 -81.8 -51.23 8.35 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.599 1.56 . . . . 0.0 110.131 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -46.31 -38.55 8.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.938 3.295 . . . . 0.0 113.634 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -54.69 -33.25 60.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.357 -1.464 . . . . 0.0 114.437 176.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mp -117.02 24.56 11.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -63.16 3.53 0.26 Allowed 'General case' 0 N--CA 1.43 -1.439 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -173.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 -28.17 0.23 Allowed Glycine 0 N--CA 1.429 -1.775 0 CA-C-N 121.801 2.091 . . . . 0.0 111.518 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -88.42 -28.16 21.08 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.594 -1.533 . . . . 0.0 113.907 -167.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -87.47 15.6 6.42 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 -152.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -11.61 60.42 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 116.982 -3.573 . . . . 0.0 114.148 166.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -93.09 -38.06 11.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.243 2.217 . . . . 0.0 113.49 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -93.18 -49.24 6.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.028 -1.045 . . . . 0.0 113.344 -175.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -42.5 -61.61 1.17 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.576 1.95 . . . . 0.0 114.253 176.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -42.36 -35.67 1.07 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 119.64 3.2 . . . . 0.0 119.64 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtm -88.08 -41.05 13.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.065 -2.272 . . . . 0.0 112.248 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -76.52 -22.78 53.95 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.421 -1.424 . . . . 0.0 111.653 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.5 -58.95 4.56 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 124.854 1.262 . . . . 0.0 113.23 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.98 -49.03 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.737 1.615 . . . . 0.0 115.345 172.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.0 69.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.62 -57.85 10.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.3 1.04 . . . . 0.0 111.298 173.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 12' ' ' VAL . 77.5 t -72.48 -20.05 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 125.319 1.447 . . . . 0.0 111.35 -171.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.62 -49.99 66.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 118.637 -2.54 . . . . 0.0 112.309 169.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -69.99 -27.2 64.51 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.852 1.661 . . . . 0.0 111.928 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 27' ' ' LEU 0.356 9.3 mp -81.87 -45.46 15.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.374 2.269 . . . . 0.0 111.053 178.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.19 -32.41 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 119.414 -2.054 . . . . 0.0 113.269 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.21 -29.37 31.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 170.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.24 -47.26 8.99 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.691 1.196 . . . . 0.0 112.485 166.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -90.52 -11.18 40.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -159.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -43.7 -54.3 5.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.358 2.263 . . . . 0.0 116.355 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.259 1.593 0 O-C-N 121.139 -0.976 . . . . 0.0 110.418 -176.543 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.515 HG12 ' H ' ' A' ' 4' ' ' LEU . 5.2 t . . . . . 0 CA--C 1.49 -1.365 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.0 p -67.92 -27.96 67.08 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 128.343 2.657 . . . . 0.0 114.469 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -64.62 -47.76 77.41 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.756 -1.215 . . . . 0.0 113.708 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' H ' HG12 ' A' ' 1' ' ' VAL . 64.3 tp -57.52 -48.84 78.2 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.085 2.154 . . . . 0.0 110.833 178.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 1.8 t80 -45.59 -43.89 12.5 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.667 2.387 . . . . 0.0 111.904 174.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -78.52 -32.45 48.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.518 -1.364 . . . . 0.0 114.216 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.45 -51.81 67.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 123.678 1.704 . . . . 0.0 110.934 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -88.96 -22.64 22.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.622 -168.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.419 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -47.0 73.03 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.307 2.003 . . . . 0.0 113.515 175.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -65.07 -20.46 66.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.077 1.751 . . . . 0.0 113.218 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.17 -58.06 3.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 123.926 0.89 . . . . 0.0 110.493 167.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.403 HG21 HD22 ' A' ' 27' ' ' LEU . 27.4 m -64.22 -27.61 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 O-C-N 119.96 -1.713 . . . . 0.0 113.974 -171.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.84 -18.72 62.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.42 7.52 6.4 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.039 1.336 . . . . 0.0 113.541 -172.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.491 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.5 tp -68.8 153.6 95.77 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.855 -1.778 . . . . 0.0 110.73 -175.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.491 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 82.1 Cg_endo -75.27 -17.52 18.9 Favored 'Trans proline' 0 C--N 1.301 -1.953 0 C-N-CA 122.948 2.432 . . . . 0.0 111.708 -169.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 85.1 m -107.28 78.27 1.21 Allowed 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.135 -3.283 . . . . 0.0 102.135 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 95.3 mttt -57.76 151.58 41.49 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -176.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 85.2 Cg_exo -65.0 148.94 89.95 Favored 'Trans proline' 0 C--N 1.3 -1.993 0 C-N-CA 122.753 2.302 . . . . 0.0 114.949 -164.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.3 t -82.12 160.67 23.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.526 -1.358 . . . . 0.0 112.067 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.1 m -47.99 -59.87 3.04 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.126 2.57 . . . . 0.0 117.924 -162.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.91 -12.86 59.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.827 1.251 . . . . 0.0 113.403 -175.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -89.38 -43.89 10.58 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.574 1.95 . . . . 0.0 108.788 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.7 tt -53.28 -37.66 62.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.821 2.848 . . . . 0.0 114.556 171.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -40.01 63.18 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.761 -1.212 . . . . 0.0 112.934 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.44 -40.47 85.43 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.977 -1.702 . . . . 0.0 111.166 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 12' ' ' VAL . 26.1 mt -56.05 -48.25 76.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.495 1.518 . . . . 0.0 114.021 166.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -55.01 -55.25 32.97 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.503 1.521 . . . . 0.0 111.99 173.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.5 -50.77 67.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 119.582 1.083 . . . . 0.0 112.931 -176.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 76' ' ' LEU . 3.8 mp -70.5 -38.87 74.38 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.419 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 38.2 t80 -55.62 -58.41 7.9 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.223 1.009 . . . . 0.0 109.831 173.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -58.32 -35.81 72.43 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.948 -1.72 . . . . 0.0 113.689 176.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.46 -58.47 7.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 119.338 0.972 . . . . 0.0 113.121 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -84.4 -15.34 46.65 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.098 -1.626 . . . . 0.0 113.379 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.7 m -67.65 -62.42 1.42 Allowed 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.971 -1.08 . . . . 0.0 113.61 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.4 p -87.25 -38.87 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.957 -1.714 . . . . 0.0 112.24 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.79 -42.34 1.74 Allowed Glycine 0 N--CA 1.429 -1.801 0 O-C-N 120.779 -1.2 . . . . 0.0 113.278 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -128.82 171.94 11.78 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -169.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.4 p-10 -60.54 124.53 20.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.1 -1.625 . . . . 0.0 113.786 158.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -103.08 -86.17 0.44 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 121.137 -0.977 . . . . 0.0 111.14 -175.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -84.67 81.93 8.64 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.639 -1.288 . . . . 0.0 113.843 -164.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -76.63 45.42 0.4 Allowed 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 125.117 2.389 . . . . 0.0 113.573 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.22 81.01 2.35 Favored Pre-proline 0 N--CA 1.43 -1.47 0 C-N-CA 126.558 1.943 . . . . 0.0 107.852 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.71 152.4 69.54 Favored 'Trans proline' 0 C--N 1.299 -2.057 0 C-N-CA 122.473 2.116 . . . . 0.0 109.634 165.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -123.72 0.24 Allowed Glycine 0 N--CA 1.431 -1.694 0 N-CA-C 119.425 2.53 . . . . 0.0 119.425 -160.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 47' ' ' PHE . 2.4 pt -116.89 -68.85 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 124.56 1.144 . . . . 0.0 111.698 -163.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.429 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -80.53 6.39 12.58 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.785 2.034 . . . . 0.0 112.073 169.706 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.451 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 24.8 m120 -81.39 60.28 4.38 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 128.073 2.549 . . . . 0.0 113.022 -174.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 49.5 tpp -69.35 -36.3 76.73 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.333 1.453 . . . . 0.0 113.063 -175.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -74.06 -40.84 62.52 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.912 -1.118 . . . . 0.0 110.557 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.451 ' HB2' ' HB3' ' A' ' 48' ' ' ASN . 5.2 m-20 -61.78 -38.99 90.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.631 1.172 . . . . 0.0 114.154 176.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -49.64 -39.42 35.99 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 170.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -77.98 -48.64 15.76 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.715 -1.241 . . . . 0.0 112.923 173.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -59.35 -42.38 91.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -177.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -67.22 -32.46 73.52 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.448 1.099 . . . . 0.0 111.439 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -73.68 -31.17 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.059 -1.651 . . . . 0.0 112.754 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.18 62.21 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.429 -1.419 . . . . 0.0 113.39 170.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -87.39 -47.49 8.74 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.262 -1.524 . . . . 0.0 110.55 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.77 -7.17 14.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.711 -1.868 . . . . 0.0 114.785 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.83 -37.74 71.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.623 -1.923 . . . . 0.0 112.066 162.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.4 mp -116.93 30.96 7.03 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 126.2 1.8 . . . . 0.0 113.1 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -50.07 -33.21 17.67 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 120.628 3.566 . . . . 0.0 120.628 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.24 -47.22 2.06 Favored Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -159.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -115.38 -35.73 4.53 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-O 122.164 0.983 . . . . 0.0 112.397 -164.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.24 39.36 0.82 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -136.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -77.94 -39.07 43.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.612 1.565 . . . . 0.0 108.131 163.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -67.92 -33.59 74.99 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.009 2.123 . . . . 0.0 110.581 -179.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.46 -45.01 14.12 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 123.974 0.909 . . . . 0.0 111.652 172.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.97 -60.65 1.54 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -43.3 -43.93 5.19 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 172.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -88.26 -19.82 26.28 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.448 -2.033 . . . . 0.0 115.914 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.31 -28.57 19.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.692 -1.255 . . . . 0.0 110.952 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -64.27 -43.92 93.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.826 -1.171 . . . . 0.0 113.379 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 14.3 tt -39.28 -52.05 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 166.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.55 -22.84 56.7 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.436 HD11 HD13 ' A' ' 30' ' ' LEU . 89.4 mt -69.13 -63.38 1.07 Allowed 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.739 -1.226 . . . . 0.0 109.071 167.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.424 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 53.1 t -66.34 -24.77 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 C-N-CA 126.155 1.782 . . . . 0.0 111.087 -166.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.39 -44.81 92.72 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.028 -1.67 . . . . 0.0 114.163 171.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -82.0 -24.38 35.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.932 0.872 . . . . 0.0 111.852 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 65.2 mt -71.44 -50.11 34.94 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.126 1.37 . . . . 0.0 109.487 175.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.7 mt -64.74 -33.48 63.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 O-C-N 119.484 -2.01 . . . . 0.0 112.738 176.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.36 -30.66 65.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.62 -1.925 . . . . 0.0 114.94 172.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -87.25 -38.08 16.64 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.348 1.459 . . . . 0.0 111.392 173.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -106.58 -13.68 15.24 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -158.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 59.9 p -42.35 -54.99 3.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.208 1.003 . . . . 0.0 108.932 172.305 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 m . . . . . 0 CA--C 1.49 -1.351 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 m -75.45 6.87 4.1 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.441 2.696 . . . . 0.0 114.654 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 62.9 tp60 -71.02 -51.49 25.07 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.775 -1.828 . . . . 0.0 111.005 175.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.62 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -68.39 -27.58 66.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.265 1.826 . . . . 0.0 111.785 178.216 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.5 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 58.3 t80 -56.69 -50.56 71.77 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 123.911 0.884 . . . . 0.0 110.342 168.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -79.87 -11.99 59.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.092 -1.63 . . . . 0.0 113.729 179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -66.09 -57.99 6.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.431 -2.043 . . . . 0.0 111.523 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.474 ' HB3' HG11 ' A' ' 77' ' ' VAL . 47.9 mttm -81.09 -36.42 30.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 113.66 -1.609 . . . . 0.0 113.715 -169.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.417 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.89 -39.57 76.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.578 -1.951 . . . . 0.0 114.079 -173.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -65.3 -20.79 66.57 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.593 1.557 . . . . 0.0 113.27 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.28 -50.24 11.22 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.039 -1.038 . . . . 0.0 111.878 171.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.497 HG11 HG13 ' A' ' 77' ' ' VAL . 30.8 m -66.56 -21.85 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.024 -1.672 . . . . 0.0 113.473 -175.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -69.33 -19.63 63.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 172.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -142.86 25.08 1.81 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.722 -1.236 . . . . 0.0 113.297 -173.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.6 tp -70.24 153.94 94.87 Favored Pre-proline 0 N--CA 1.43 -1.427 0 C-N-CA 125.965 1.706 . . . . 0.0 110.1 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.49 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 85.5 Cg_endo -74.24 -21.22 17.95 Favored 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 124.113 2.505 . . . . 0.0 111.17 -173.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.4 m -102.46 74.74 1.41 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 104.065 -2.568 . . . . 0.0 104.065 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -58.11 150.78 49.73 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -175.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -61.59 140.19 85.45 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 123.087 2.525 . . . . 0.0 115.329 -164.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.1 m -73.61 159.52 32.96 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.825 1.25 . . . . 0.0 113.213 -177.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.8 t -55.69 -47.6 76.49 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 118.033 2.605 . . . . 0.0 118.033 -160.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -86.26 -21.33 27.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.401 -2.062 . . . . 0.0 112.749 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -72.86 -36.94 67.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.673 1.589 . . . . 0.0 112.334 173.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 31.2 tp -52.13 -40.61 61.6 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.85 2.86 . . . . 0.0 116.22 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . 0.344 1.3 tm? -61.3 -47.86 84.02 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.619 1.968 . . . . 0.0 114.434 175.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -64.26 -47.27 80.22 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.074 0.949 . . . . 0.0 110.303 174.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.66 -37.34 85.99 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 175.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.5 t80 -58.35 -57.15 14.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.274 2.306 . . . . 0.0 111.295 167.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.22 -51.42 54.15 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 119.664 1.12 . . . . 0.0 113.716 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' A' ' 69' ' ' ALA . 4.0 mm? -74.1 -37.61 64.1 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.338 1.606 . . . . 0.0 115.338 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.417 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 49.8 t80 -62.31 -52.98 61.49 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.115 -2.241 . . . . 0.0 111.289 174.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.4 mmmt -59.04 -37.96 78.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.038 -2.289 . . . . 0.0 113.285 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . 27.8 mt-30 -48.45 -61.46 2.0 Allowed 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 170.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -84.56 -21.14 30.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.682 -1.261 . . . . 0.0 112.743 -175.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.5 m -62.94 -63.27 1.26 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 113.005 176.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.1 m -87.51 -27.45 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.774 -1.204 . . . . 0.0 114.14 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.54 -13.27 67.02 Favored Glycine 0 N--CA 1.431 -1.674 0 O-C-N 120.307 -1.495 . . . . 0.0 116.084 173.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -144.92 164.08 32.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 -177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -53.0 111.5 0.68 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 153.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -109.96 -75.33 0.63 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.988 1.715 . . . . 0.0 111.619 -166.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.03 81.38 6.23 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.965 -1.709 . . . . 0.0 112.301 -174.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -79.49 52.42 1.38 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.084 1.421 . . . . 0.0 112.64 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 21.8 ttmm -160.15 84.94 2.06 Favored Pre-proline 0 N--CA 1.43 -1.443 0 O-C-N 120.544 -1.347 . . . . 0.0 107.774 160.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.48 154.99 64.5 Favored 'Trans proline' 0 N--CA 1.434 -2.02 0 C-N-CA 122.295 1.997 . . . . 0.0 108.705 157.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.81 -170.33 32.25 Favored Glycine 0 N--CA 1.43 -1.702 0 N-CA-C 117.049 1.58 . . . . 0.0 117.049 -159.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 11.9 pt -90.58 -48.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.953 -1.322 . . . . 0.0 110.851 -156.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.0 p90 -90.65 1.16 57.05 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.993 2.117 . . . . 0.0 109.523 168.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -84.51 61.91 6.95 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.472 -1.393 . . . . 0.0 112.803 -166.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -33.07 72.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.949 1.7 . . . . 0.0 113.709 -177.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -61.95 -54.79 36.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.973 1.709 . . . . 0.0 111.455 173.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -66.92 -38.73 86.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.415 1.486 . . . . 0.0 110.987 -177.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.3 mtt180 -57.56 -36.55 71.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -71.37 -46.5 60.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.014 -1.679 . . . . 0.0 112.841 173.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -58.79 -45.0 90.87 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.228 1.411 . . . . 0.0 113.023 175.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -66.51 -31.25 71.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.409 1.483 . . . . 0.0 113.171 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -70.16 -41.55 73.67 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.297 -1.502 . . . . 0.0 111.277 175.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.04 -18.13 64.6 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.851 -1.156 . . . . 0.0 113.455 175.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 13.0 t90 -85.18 -50.61 7.25 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.959 1.704 . . . . 0.0 109.47 176.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.2 tm-20 -57.69 -22.56 46.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.84 2.856 . . . . 0.0 113.364 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -50.07 -32.46 15.7 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.686 1.594 . . . . 0.0 114.101 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 4.4 mp -115.84 17.93 15.85 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.677 1.732 . . . . 0.0 115.677 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt -31.09 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.42 1 N-CA-C 123.81 4.744 . . . . 0.0 123.81 -176.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -106.85 -40.24 1.88 Allowed Glycine 0 N--CA 1.429 -1.769 0 CA-C-N 120.243 1.383 . . . . 0.0 113.652 -176.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.4 pttt -95.8 -3.37 45.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.911 -1.346 . . . . 0.0 112.471 -172.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.5 m -26.78 -59.79 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 130.055 3.342 . . . . 0.0 118.68 -174.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -57.0 -38.99 73.85 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -78.1 -37.04 47.31 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.037 1.735 . . . . 0.0 111.807 -173.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.15 -37.88 19.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.997 -1.064 . . . . 0.0 110.342 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.634 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -54.12 -62.36 1.71 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.17 1.174 . . . . 0.0 114.17 176.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -43.89 -32.63 1.14 Allowed 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 119.545 3.165 . . . . 0.0 119.545 176.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -88.39 -37.65 15.72 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.837 -2.414 . . . . 0.0 114.15 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -71.74 -27.0 62.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.735 -1.228 . . . . 0.0 111.151 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' CE2' HG21 ' A' ' 77' ' ' VAL . 37.0 t80 -73.32 -48.64 32.76 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.742 -0.599 . . . . 0.0 111.668 -159.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.41 ' HB ' HD12 ' A' ' 4' ' ' LEU . 18.5 tt -44.87 -48.16 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 171.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.93 -15.45 60.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.923 1.823 . . . . 0.0 115.923 -178.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 97.1 mt -76.09 -59.12 2.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.495 -1.378 . . . . 0.0 109.212 167.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG13 HG11 ' A' ' 12' ' ' VAL . 32.5 t -71.28 -27.16 28.33 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.515 -1.366 . . . . 0.0 111.779 -166.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -66.79 -37.21 84.12 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.193 -2.192 . . . . 0.0 114.032 176.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -79.56 -14.84 58.57 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.429 -1.42 . . . . 0.0 113.502 175.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 92.3 mt -81.2 -49.17 11.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.237 2.215 . . . . 0.0 110.358 172.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 68.3 mt -59.94 -31.0 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 119.181 -2.199 . . . . 0.0 112.695 174.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.13 -31.88 61.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 168.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -86.83 -35.38 19.1 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.075 -1.641 . . . . 0.0 109.904 174.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -104.38 -17.04 14.94 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.603 1.705 . . . . 0.0 115.603 -156.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . 0.306 10.3 p -46.11 -56.43 5.63 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 116.574 2.065 . . . . 0.0 116.574 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.26 1.657 0 O-C-N 120.877 -1.139 . . . . 0.0 110.445 175.29 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 115.376 1.621 . . . . 0.0 115.376 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.8 m -87.4 9.33 21.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.505 2.722 . . . . 0.0 115.371 -172.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -61.79 -46.88 87.61 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.374 -1.454 . . . . 0.0 110.957 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.606 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -70.97 -34.46 71.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.874 2.47 . . . . 0.0 112.251 175.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 14.2 t80 -60.76 -51.94 67.21 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.834 1.254 . . . . 0.0 109.645 178.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -76.63 -21.34 55.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.041 -1.037 . . . . 0.0 111.594 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -53.77 46.26 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.681 -1.262 . . . . 0.0 113.329 166.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.469 ' HB3' HG11 ' A' ' 77' ' ' VAL . 39.6 mmtm -86.36 -25.64 25.24 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 119.864 -1.773 . . . . 0.0 114.589 -173.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.503 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.83 -45.45 74.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 124.653 2.168 . . . . 0.0 114.009 -175.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.8 mmmt -58.37 -26.81 63.61 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.395 2.278 . . . . 0.0 113.442 170.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.97 -56.57 4.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 123.999 0.919 . . . . 0.0 110.943 171.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.584 HG11 HG13 ' A' ' 77' ' ' VAL . 25.1 m -63.24 -31.68 53.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 O-C-N 120.707 -1.245 . . . . 0.0 113.536 -172.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -69.82 -26.6 64.32 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 176.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -107.87 -9.86 15.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.575 1.55 . . . . 0.0 112.851 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.502 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.7 tp -62.01 151.06 81.62 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 127.946 2.498 . . . . 0.0 111.685 -172.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.502 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 88.4 Cg_endo -74.06 -18.34 21.35 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.392 2.061 . . . . 0.0 112.104 -169.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.3 m -106.1 79.18 1.38 Allowed 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.659 -3.089 . . . . 0.0 102.659 174.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.2 mtmp? -61.22 154.92 59.64 Favored Pre-proline 0 N--CA 1.431 -1.398 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -171.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -66.69 144.97 74.06 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 C-N-CA 122.698 2.265 . . . . 0.0 113.958 -168.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 13.7 t -78.38 144.52 35.86 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 52.7 m -41.19 -59.79 1.42 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 130.221 3.409 . . . . 0.0 117.417 -167.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -87.8 -13.4 42.33 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.605 -1.309 . . . . 0.0 112.349 -171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -82.12 -50.18 9.34 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.059 1.344 . . . . 0.0 110.042 175.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -42.21 -41.03 2.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 129.245 3.018 . . . . 0.0 115.442 177.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.28 -48.45 80.43 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 -58.54 -43.49 89.27 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.648 1.579 . . . . 0.0 114.453 170.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -63.97 -40.46 96.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.614 1.966 . . . . 0.0 111.71 176.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -49.82 -49.01 50.46 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 128.268 2.627 . . . . 0.0 112.468 171.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -45.54 65.54 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.765 2.075 . . . . 0.0 114.857 175.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -71.74 -49.37 39.8 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.805 -1.184 . . . . 0.0 113.885 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.503 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.1 t80 -52.66 -52.85 53.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.344 2.257 . . . . 0.0 111.196 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.7 mmmt -62.25 -37.59 86.03 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.516 -1.365 . . . . 0.0 111.784 172.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -57.04 14.65 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.258 . . -89.78 -7.09 55.21 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.708 -1.245 . . . . 0.0 113.532 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -68.02 -61.01 2.06 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.976 -1.702 . . . . 0.0 112.635 166.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 m -87.33 -42.87 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.81 -22.87 38.38 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.685 -1.259 . . . . 0.0 114.047 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -125.67 159.89 31.08 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 178.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -55.8 107.69 0.37 Allowed 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 119.976 -1.703 . . . . 0.0 113.518 152.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -78.21 -62.3 1.72 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.989 -1.694 . . . . 0.0 111.179 -173.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.49 168.28 19.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.64 1.176 . . . . 0.0 109.022 169.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -146.08 29.08 1.09 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.956 1.836 . . . . 0.0 106.255 171.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.5 ptmt -142.72 78.95 15.44 Favored Pre-proline 0 N--CA 1.43 -1.444 0 O-C-N 120.833 -1.167 . . . . 0.0 111.044 -168.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -77.41 168.56 22.65 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 C-N-CA 122.699 2.266 . . . . 0.0 110.242 160.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -154.33 6.2 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 120.413 2.925 . . . . 0.0 120.413 -168.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.436 HG13 ' H ' ' A' ' 47' ' ' PHE . 3.2 pt -104.12 -64.72 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 125.321 1.448 . . . . 0.0 110.631 -165.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.8 OUTLIER -84.18 -4.94 59.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.66 1.584 . . . . 0.0 111.392 168.506 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -76.3 69.32 2.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.189 2.195 . . . . 0.0 113.851 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 48.9 mtm -61.96 -39.7 93.02 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.22 1.408 . . . . 0.0 113.29 178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -41.66 93.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 174.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.31 -49.41 64.27 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.429 -1.419 . . . . 0.0 111.606 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 mmm-85 -45.5 -60.18 2.31 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.37 1.868 . . . . 0.0 115.533 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -72.92 -38.37 66.88 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 122.218 1.009 . . . . 0.0 112.687 -176.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -85.88 -13.64 47.28 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.242 -2.161 . . . . 0.0 113.563 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 66.8 t90 -68.75 -36.75 78.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.406 -1.434 . . . . 0.0 110.935 158.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -69.98 -26.36 64.06 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.465 -2.022 . . . . 0.0 112.551 175.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.89 -25.03 64.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.792 -1.192 . . . . 0.0 113.229 169.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.449 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 19.2 t90 -81.62 -46.72 13.99 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 125.311 1.444 . . . . 0.0 110.302 174.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -53.82 -30.35 44.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 128.894 2.878 . . . . 0.0 115.089 174.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -51.72 -31.87 28.06 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.618 -1.926 . . . . 0.0 113.45 167.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 46.5 mt -105.12 -1.93 24.92 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.355 1.462 . . . . 0.0 114.261 -173.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -29.74 -26.43 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.419 2 N-CA-C 124.78 5.104 . . . . 0.0 124.78 -161.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.13 31.54 0.4 Allowed Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 121.901 2.137 . . . . 0.0 110.878 170.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -117.36 -51.33 2.52 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 123.21 1.481 . . . . 0.0 110.448 -176.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.0 m -86.44 35.71 0.67 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -162.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -66.28 -10.21 40.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.21 -1.556 . . . . 0.0 112.783 150.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -87.22 -35.03 18.77 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.699 2.799 . . . . 0.0 112.601 171.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -94.02 -53.92 3.79 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.366 -1.458 . . . . 0.0 114.905 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 73' ' ' TYR . . . -43.51 -52.21 6.29 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.135 2.174 . . . . 0.0 113.779 -174.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -41.41 -48.71 3.82 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.76 2.874 . . . . 0.0 118.76 170.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.07 -37.52 15.06 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.689 2.796 . . . . 0.0 112.484 -170.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -77.19 -28.27 53.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.601 -1.312 . . . . 0.0 112.139 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 77' ' ' VAL . 32.9 t80 -62.58 -50.08 72.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.243 1.017 . . . . 0.0 113.654 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.438 ' HB ' HD12 ' A' ' 4' ' ' LEU . 18.8 tt -52.75 -42.48 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 116.498 2.036 . . . . 0.0 116.498 177.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.38 -17.27 61.3 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.022 -1.674 . . . . 0.0 115.167 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.3 mt -78.19 -53.94 6.79 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.455 -1.403 . . . . 0.0 110.265 167.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.584 HG13 HG11 ' A' ' 12' ' ' VAL . 13.3 t -68.61 -25.79 31.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.105 2.162 . . . . 0.0 112.069 -169.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.55 -34.84 78.69 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.516 -1.99 . . . . 0.0 113.077 172.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -75.28 -29.7 60.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.387 1.475 . . . . 0.0 111.959 177.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.59 -51.86 25.48 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 126.583 1.953 . . . . 0.0 110.09 173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.9 mt -62.16 -33.67 59.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 O-C-N 120.014 -1.678 . . . . 0.0 112.973 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.73 -22.29 61.85 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 116.434 2.012 . . . . 0.0 116.434 169.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -87.12 -46.72 9.51 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.697 -1.877 . . . . 0.0 109.339 165.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -98.1 -15.98 19.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 116.422 2.008 . . . . 0.0 116.422 -150.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 23.0 t -49.3 -54.89 14.75 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.627 1.558 . . . . 0.0 114.865 173.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--O 1.261 1.679 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 168.253 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.491 -1.32 0 CA-C-O 122.888 1.328 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.0 p -64.87 -41.17 95.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 128.86 2.864 . . . . 0.0 114.612 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -70.19 -37.25 75.07 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.881 -1.762 . . . . 0.0 112.498 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.78 -43.97 87.21 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.802 1.241 . . . . 0.0 110.939 175.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.7 OUTLIER -47.96 -46.06 31.92 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.911 1.684 . . . . 0.0 111.665 173.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -77.1 -36.23 55.77 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.883 -1.135 . . . . 0.0 112.833 -176.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.9 tp10 -60.57 -51.91 67.42 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.734 1.214 . . . . 0.0 112.376 174.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -84.83 -23.52 29.03 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.497 -1.377 . . . . 0.0 114.23 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.458 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.24 -46.96 72.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.235 -2.166 . . . . 0.0 113.47 178.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -68.36 -15.79 63.69 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 113.661 -1.609 . . . . 0.0 113.47 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.88 -63.93 1.03 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 121.093 -1.005 . . . . 0.0 109.58 162.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.403 HG11 HG13 ' A' ' 77' ' ' VAL . 34.8 m -63.09 -31.52 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.323 -1.486 . . . . 0.0 114.161 -166.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.59 -14.21 61.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.964 -1.085 . . . . 0.0 113.79 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -137.46 27.14 2.82 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.547 1.139 . . . . 0.0 112.47 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.441 HD11 HD13 ' A' ' 81' ' ' ILE . 8.1 mt -72.21 164.38 59.74 Favored Pre-proline 0 N--CA 1.43 -1.433 0 O-C-N 120.072 -1.642 . . . . 0.0 110.734 175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.62 -29.92 15.47 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.035 2.477 . . . . 0.0 111.184 178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 87.6 m -102.4 77.96 1.69 Allowed 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 104.897 -2.26 . . . . 0.0 104.897 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -58.78 152.15 49.51 Favored Pre-proline 0 N--CA 1.431 -1.387 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_exo -67.46 137.83 44.2 Favored 'Trans proline' 0 C--N 1.3 -1.977 0 C-N-CA 122.743 2.295 . . . . 0.0 113.015 -162.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.8 t -70.4 160.57 32.09 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 119.806 1.185 . . . . 0.0 113.126 -176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.4 m -54.26 -53.78 49.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -158.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -79.29 -16.59 56.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.793 -1.192 . . . . 0.0 113.023 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -83.82 -45.24 13.5 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.669 1.588 . . . . 0.0 109.605 -178.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 28.6 tp -48.13 -34.02 9.2 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.934 2.894 . . . . 0.0 115.567 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -39.67 65.55 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.204 -1.56 . . . . 0.0 113.81 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -72.65 -38.49 67.65 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.496 -1.378 . . . . 0.0 109.512 177.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -58.1 -46.74 85.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.893 1.677 . . . . 0.0 112.462 171.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -50.93 -57.97 7.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.205 2.202 . . . . 0.0 112.662 169.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.04 -48.98 43.39 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -178.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 69' ' ' ALA . 3.6 mm? -76.17 -38.97 55.98 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.458 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 12.8 t80 -56.56 -61.77 2.18 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.733 1.213 . . . . 0.0 112.116 173.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 22.3 mmmt -55.18 -37.08 66.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.983 1.713 . . . . 0.0 112.307 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -54.02 -60.55 3.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -83.03 -8.57 59.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.844 -1.785 . . . . 0.0 112.743 -178.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 45.6 m -64.31 -67.68 0.41 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.95 -1.094 . . . . 0.0 111.251 166.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 5.7 m -87.54 -54.28 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.457 -1.402 . . . . 0.0 113.484 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.72 -28.88 5.57 Favored Glycine 0 N--CA 1.431 -1.688 0 C-N-CA 125.489 1.519 . . . . 0.0 113.402 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -119.49 171.72 8.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.565 1.146 . . . . 0.0 109.095 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -72.98 70.15 1.01 Allowed 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 123.443 1.592 . . . . 0.0 112.078 161.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -79.19 -41.98 27.1 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.229 -1.545 . . . . 0.0 114.472 -160.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.7 mmpt? -85.47 81.6 8.64 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.712 -1.867 . . . . 0.0 112.778 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -84.29 48.1 1.44 Allowed 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.023 1.392 . . . . 0.0 113.468 -170.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -153.86 89.89 3.38 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 125.212 1.405 . . . . 0.0 108.201 170.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -80.5 179.38 6.15 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 C-N-CA 122.66 2.24 . . . . 0.0 110.611 169.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.46 -175.15 3.18 Favored Glycine 0 N--CA 1.429 -1.772 0 N-CA-C 121.151 3.22 . . . . 0.0 121.151 -161.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 16.7 pt -87.34 -50.13 14.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.28 -1.718 . . . . 0.0 112.378 -170.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -91.07 29.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.614 1.965 . . . . 0.0 111.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.325 0.1 OUTLIER -61.33 115.08 3.56 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.861 2.911 . . . . 0.0 118.861 -156.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 62.5 tpp -126.18 -64.75 1.02 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 170.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -58.97 -42.62 90.34 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.252 1.421 . . . . 0.0 114.285 177.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -63.77 -27.1 68.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.946 1.091 . . . . 0.0 113.946 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 22.3 mtm-85 -67.56 -46.35 72.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.335 -1.478 . . . . 0.0 112.008 174.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -57.38 -48.72 78.31 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.298 1.039 . . . . 0.0 113.064 174.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -54.32 -54.7 36.72 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 125.546 1.538 . . . . 0.0 114.406 172.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -70.91 -29.35 65.38 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.536 -1.353 . . . . 0.0 113.355 -176.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -69.78 -39.15 76.79 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 126.523 1.929 . . . . 0.0 112.219 174.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -69.24 -26.17 64.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.788 -1.195 . . . . 0.0 112.158 175.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.43 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 7.9 t90 -78.86 -45.22 21.19 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.741 2.016 . . . . 0.0 111.53 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -58.94 -20.96 56.93 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.856 2.862 . . . . 0.0 113.812 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -61.16 -30.14 70.21 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.718 -1.864 . . . . 0.0 113.424 168.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 48.4 mt -112.8 9.46 19.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.812 1.245 . . . . 0.0 112.71 -172.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -26.44 -34.0 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.417 2 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -165.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -158.94 32.97 0.47 Allowed Glycine 0 N--CA 1.43 -1.717 0 O-C-N 119.03 -2.294 . . . . 0.0 113.528 169.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.8 pttp -116.06 -43.49 2.97 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 119.06 1.43 . . . . 0.0 110.256 175.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.9 m -87.56 46.14 1.35 Allowed 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.45 -1.406 . . . . 0.0 113.779 -161.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -74.59 -38.07 62.73 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.832 -2.418 . . . . 0.0 108.002 158.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.61 -44.99 61.23 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 129.965 3.306 . . . . 0.0 110.282 -177.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -75.02 -47.47 28.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.731 174.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.556 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -43.19 -59.59 2.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.947 2.202 . . . . 0.0 116.947 177.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -47.56 -29.33 2.77 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 120.344 3.461 . . . . 0.0 120.344 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -88.86 -34.41 17.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.432 2.293 . . . . 0.0 114.699 174.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -73.42 -31.14 63.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.457 -1.402 . . . . 0.0 110.905 174.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.465 ' CE2' HG21 ' A' ' 77' ' ' VAL . 18.8 t80 -67.77 -50.59 56.3 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.654 1.181 . . . . 0.0 112.2 -166.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.98 -47.98 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 167.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.37 -50.16 48.79 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.08 -43.38 78.69 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.695 -1.253 . . . . 0.0 113.63 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.465 HG21 ' CE2' ' A' ' 73' ' ' TYR . 18.1 t -65.73 -25.46 36.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.513 1.125 . . . . 0.0 111.3 176.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.41 -41.98 99.1 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.032 -2.292 . . . . 0.0 113.767 171.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -66.01 -30.88 71.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.075 0.95 . . . . 0.0 113.051 175.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.3 mt -71.41 -57.19 4.67 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.614 1.565 . . . . 0.0 109.816 175.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.441 HD13 HD11 ' A' ' 15' ' ' LEU . 2.6 mm -57.23 -39.46 67.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 126.402 1.881 . . . . 0.0 113.555 -178.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.22 -35.81 62.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 173.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -87.36 -37.96 16.63 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.014 -1.054 . . . . 0.0 111.4 173.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -101.19 -16.58 16.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.026 1.491 . . . . 0.0 115.026 -157.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 51.0 p -47.36 -54.93 9.89 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 172.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.26 1.646 0 O-C-N 120.396 -1.44 . . . . 0.0 109.065 172.153 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.3 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 122.974 1.368 . . . . 0.0 114.233 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 p -57.85 -35.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.531 2.732 . . . . 0.0 112.991 167.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -64.71 -39.15 93.16 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.679 -1.263 . . . . 0.0 114.368 177.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 54.2 tp -60.47 -46.5 89.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 124.907 2.289 . . . . 0.0 111.744 176.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -54.26 -42.74 70.28 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 128.739 2.816 . . . . 0.0 109.019 177.291 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -72.85 -39.71 66.28 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.095 0.958 . . . . 0.0 113.258 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.33 -43.36 96.49 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.944 1.354 . . . . 0.0 111.451 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.7 mppt? -90.39 -24.11 20.88 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 114.188 -1.369 . . . . 0.0 114.058 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.504 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.6 -45.18 76.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.866 -2.396 . . . . 0.0 113.532 176.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -59.18 -19.2 43.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.698 1.999 . . . . 0.0 113.836 170.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.06 -58.95 2.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 121.26 -0.9 . . . . 0.0 110.39 170.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 33.9 m -61.39 -26.14 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.241 -1.537 . . . . 0.0 113.586 -170.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -73.79 -12.66 60.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.961 1.467 . . . . 0.0 114.961 175.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -144.89 29.6 1.21 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.52 -1.363 . . . . 0.0 112.205 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.4 mt -71.99 156.17 91.14 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.747 -1.846 . . . . 0.0 110.11 175.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -72.47 -24.3 19.27 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.692 2.261 . . . . 0.0 110.605 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 92.8 m -101.97 82.07 2.19 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 104.304 -2.48 . . . . 0.0 104.304 168.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 52.6 mtmt -56.88 148.59 48.04 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 126.766 2.026 . . . . 0.0 114.139 179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 86.9 Cg_exo -64.08 158.38 48.2 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 C-N-CA 123.699 2.932 . . . . 0.0 115.196 -163.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.7 m -74.71 160.56 30.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.77 1.168 . . . . 0.0 113.628 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 87.7 m -64.6 -60.2 3.41 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.72 2.118 . . . . 0.0 116.72 -157.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -77.31 -23.25 51.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.447 -2.033 . . . . 0.0 112.154 176.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.17 -35.68 66.46 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.767 2.027 . . . . 0.0 112.286 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 65.2 tp -51.26 -39.27 56.35 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 126.82 2.048 . . . . 0.0 115.348 169.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -77.98 -32.14 51.14 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.537 -1.977 . . . . 0.0 114.311 -173.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -71.52 -31.4 67.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.878 -1.764 . . . . 0.0 112.992 167.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -67.18 -42.49 84.15 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 127.343 2.257 . . . . 0.0 111.592 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -47.16 -55.01 9.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.481 2.712 . . . . 0.0 112.276 168.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.11 -47.5 65.27 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.512 1.125 . . . . 0.0 113.958 -178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 69' ' ' ALA . 0.6 OUTLIER -66.67 -45.63 78.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.078 1.51 . . . . 0.0 115.078 175.219 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.504 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.7 t80 -58.01 -54.74 43.58 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.49 1.516 . . . . 0.0 110.856 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -56.49 -38.69 72.09 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.053 -1.655 . . . . 0.0 113.408 171.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -53.79 -60.97 2.63 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.147 1.165 . . . . 0.0 114.147 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -90.72 -8.32 50.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -178.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 m -64.62 -60.51 3.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 120.419 1.463 . . . . 0.0 113.04 167.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.2 m -88.11 -35.48 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.669 -1.27 . . . . 0.0 114.414 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.01 -23.8 34.11 Favored Glycine 0 N--CA 1.43 -1.744 0 O-C-N 120.333 -1.479 . . . . 0.0 114.728 178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -123.97 163.46 21.32 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 118.883 1.342 . . . . 0.0 107.405 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -59.18 84.27 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 155.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -79.04 -64.67 1.13 Allowed 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.674 -1.891 . . . . 0.0 115.379 -165.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.25 81.61 8.63 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.227 -1.545 . . . . 0.0 112.867 -174.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -85.11 53.14 2.64 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 124.483 2.087 . . . . 0.0 112.178 -176.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -153.97 87.26 3.68 Favored Pre-proline 0 N--CA 1.43 -1.469 0 N-CA-C 105.64 -1.985 . . . . 0.0 105.64 167.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -76.43 166.19 27.88 Favored 'Trans proline' 0 C--N 1.299 -2.046 0 C-N-CA 122.06 1.84 . . . . 0.0 108.094 151.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.16 -167.38 27.79 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-N 120.609 1.55 . . . . 0.0 115.868 -167.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 10.2 pt -106.95 -42.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 121.486 -1.008 . . . . 0.0 111.436 -162.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -95.71 9.65 39.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.442 1.897 . . . . 0.0 109.679 167.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -82.07 76.36 8.96 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.998 1.319 . . . . 0.0 112.549 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 ptm -70.44 -12.04 61.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -89.12 -56.52 3.25 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.524 -1.36 . . . . 0.0 110.263 169.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -58.47 -30.73 67.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.91 1.684 . . . . 0.0 114.037 -175.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -56.1 -45.89 79.29 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.834 -1.792 . . . . 0.0 115.56 173.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -77.36 -42.3 37.07 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.238 1.015 . . . . 0.0 111.468 176.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -72.52 -34.34 67.52 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.05 1.34 . . . . 0.0 114.362 -174.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 61.4 t90 -67.23 -30.31 70.18 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.474 -2.016 . . . . 0.0 111.232 168.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -74.9 -23.65 58.4 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.485 -2.009 . . . . 0.0 112.378 175.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.61 -22.24 64.45 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.386 -2.071 . . . . 0.0 112.762 168.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.6 t90 -84.19 -54.61 4.69 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.508 1.523 . . . . 0.0 109.509 173.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -21.16 65.93 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 128.132 2.573 . . . . 0.0 114.967 -175.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -61.23 -30.48 70.46 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.287 -1.508 . . . . 0.0 112.551 169.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.4 mp -103.74 29.64 5.64 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.249 1.02 . . . . 0.0 112.814 174.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -25.61 -46.68 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 121.768 3.988 . . . . 0.0 121.768 175.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -142.36 -6.47 0.74 Allowed Glycine 0 N--CA 1.43 -1.707 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -169.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -98.42 4.72 48.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.393 2.044 . . . . 0.0 110.416 171.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.0 p -35.04 -51.12 0.52 Allowed 'General case' 0 N--CA 1.43 -1.459 1 C-N-CA 131.786 4.035 . . . . 0.0 117.314 177.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -80.77 -10.5 59.72 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.135 1.374 . . . . 0.0 113.413 -172.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -87.08 -44.4 11.57 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 123.902 0.881 . . . . 0.0 109.808 168.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -90.58 -38.08 13.39 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 119.673 -1.892 . . . . 0.0 113.441 -170.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -54.81 -61.94 1.98 Allowed 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 119.109 0.868 . . . . 0.0 112.866 179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -41.89 -44.22 3.31 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 118.894 2.924 . . . . 0.0 118.894 176.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 27.7 mttp -88.06 -32.19 18.89 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.968 1.707 . . . . 0.0 113.497 -171.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.422 ' HB2' HD21 ' A' ' 30' ' ' LEU . 63.0 mm-40 -78.28 -34.4 48.91 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.555 -1.34 . . . . 0.0 110.883 171.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.442 ' CE2' HG21 ' A' ' 77' ' ' VAL . 11.2 t80 -59.66 -52.27 66.22 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -173.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.87 -53.19 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 171.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.43 -40.19 64.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.0 1.481 . . . . 0.0 115.0 -176.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.5 pp -70.41 -44.34 68.15 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 0.0 113.988 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.442 HG21 ' CE2' ' A' ' 73' ' ' TYR . 13.6 t -62.94 -31.35 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.951 1.3 . . . . 0.0 111.757 175.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -59.54 -40.76 88.27 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.706 -1.871 . . . . 0.0 113.778 174.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -77.37 -22.77 51.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.661 1.584 . . . . 0.0 113.075 178.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.9 mp -66.11 -59.99 3.24 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.327 1.451 . . . . 0.0 108.892 165.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.8 mt -65.23 -31.77 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.145 -1.597 . . . . 0.0 114.127 -173.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.86 -36.79 49.62 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.031 -1.668 . . . . 0.0 114.522 169.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -87.47 -41.24 13.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.838 -1.164 . . . . 0.0 110.53 174.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.8 m-30 -96.61 -13.01 23.18 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -158.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.3 p -52.04 -58.14 7.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 172.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--O 1.261 1.667 0 O-C-N 121.166 -0.959 . . . . 0.0 110.539 171.316 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.489 -1.369 0 CA-C-O 122.607 1.194 . . . . 0.0 113.489 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 t -79.31 -24.64 42.7 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.638 1.975 . . . . 0.0 113.384 -170.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -75.83 -39.07 57.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.437 -2.04 . . . . 0.0 112.694 171.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.7 tp -64.38 -37.86 89.02 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 123.037 1.399 . . . . 0.0 111.569 178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.626 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 2.1 t80 -46.63 -44.44 18.32 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.137 1.775 . . . . 0.0 112.028 170.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -78.62 -38.23 40.35 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 121.148 -0.97 . . . . 0.0 111.855 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -56.27 -50.21 72.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.95 1.3 . . . . 0.0 113.155 174.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HB3' HG11 ' A' ' 77' ' ' VAL . 19.7 mtpp -78.42 -32.85 48.81 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.303 -1.498 . . . . 0.0 113.499 178.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.63 -45.71 82.0 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.969 -2.332 . . . . 0.0 114.723 -176.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -66.78 -16.87 64.56 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 175.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.16 -59.35 2.82 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.613 -1.304 . . . . 0.0 110.027 164.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.773 HG11 HG13 ' A' ' 77' ' ' VAL . 10.6 m -64.4 -32.46 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 O-C-N 120.552 -1.342 . . . . 0.0 113.68 -167.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -72.55 -10.93 60.39 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -140.62 21.31 2.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.549 1.14 . . . . 0.0 112.505 -177.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.544 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.9 tp -73.96 160.22 82.31 Favored Pre-proline 0 N--CA 1.429 -1.489 0 O-C-N 118.895 -2.378 . . . . 0.0 109.913 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.544 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 94.4 Cg_endo -74.84 -21.59 16.07 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 CA-C-N 124.955 2.805 . . . . 0.0 112.309 -175.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 m -107.87 82.4 1.64 Allowed 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 102.055 -3.313 . . . . 0.0 102.055 173.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -63.55 155.31 76.36 Favored Pre-proline 0 N--CA 1.43 -1.458 0 CA-C-N 114.891 -1.049 . . . . 0.0 113.817 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -67.22 150.15 81.66 Favored 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.48 2.12 . . . . 0.0 113.354 -165.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.2 p -80.64 153.94 27.66 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.957 0.884 . . . . 0.0 112.504 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 54.6 p -75.77 -32.79 60.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.734 2.124 . . . . 0.0 116.734 -156.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.86 -31.51 31.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.32 -1.488 . . . . 0.0 109.818 176.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.49 -37.16 82.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.11 1.364 . . . . 0.0 110.373 173.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 mt -54.32 -17.96 3.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 116.983 2.216 . . . . 0.0 116.983 168.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.4 mt -71.66 -40.13 69.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.058 -2.276 . . . . 0.0 112.923 169.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -66.79 -53.25 34.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.928 0.891 . . . . 0.0 111.248 169.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.428 ' HG ' HD11 ' A' ' 80' ' ' LEU . 4.1 mm? -67.46 -36.72 81.72 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 119.863 -1.773 . . . . 0.0 115.717 -175.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -62.42 -53.43 55.01 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 120.851 1.659 . . . . 0.0 111.26 173.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.17 -42.46 66.21 Favored 'General case' 0 N--CA 1.43 -1.466 0 CA-C-N 119.587 1.085 . . . . 0.0 113.34 -178.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 69' ' ' ALA . 4.5 mm? -71.98 -51.08 23.66 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 115.528 1.677 . . . . 0.0 115.528 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -56.49 -50.77 70.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.048 -1.657 . . . . 0.0 112.526 176.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.498 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 28.1 mmmt -62.94 -33.12 74.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.985 -1.697 . . . . 0.0 113.392 174.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -56.99 -61.43 2.45 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 115.41 1.634 . . . . 0.0 115.41 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.626 ' HB3' ' CE2' ' A' ' 5' ' ' PHE 0.275 . . -79.83 -11.88 59.8 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.676 2.102 . . . . 0.0 116.676 179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 2.1 p -72.34 -50.4 27.04 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-N 121.577 1.99 . . . . 0.0 111.601 164.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.43 HG11 ' HB2' ' A' ' 40' ' ' ASP . 21.1 t -87.01 -65.15 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.449 -1.407 . . . . 0.0 111.384 -174.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.74 -12.93 46.4 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 128.24 2.829 . . . . 0.0 113.199 -174.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -125.78 153.79 43.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.153 1.781 . . . . 0.0 106.792 170.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.74 100.74 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.317 -2.114 . . . . 0.0 113.891 158.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.43 ' HB2' HG11 ' A' ' 36' ' ' VAL . 23.7 t0 -76.4 -73.63 0.27 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.743 1.617 . . . . 0.0 115.238 -162.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.67 81.33 8.48 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.952 1.301 . . . . 0.0 113.826 -172.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -77.03 43.52 0.36 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.548 2.339 . . . . 0.0 114.071 -173.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.0 ttpt -160.11 82.19 2.27 Favored Pre-proline 0 N--CA 1.43 -1.426 0 O-C-N 120.24 -1.537 . . . . 0.0 109.171 171.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -71.69 162.03 43.37 Favored 'Trans proline' 0 C--N 1.3 -2.021 0 C-N-CA 122.406 2.071 . . . . 0.0 109.845 170.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.0 -168.49 29.5 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 119.675 2.63 . . . . 0.0 119.675 -160.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.0 pt -110.69 -41.59 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.38 1.872 . . . . 0.0 108.868 -169.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -97.67 4.28 50.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.481 1.513 . . . . 0.0 109.163 167.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.37 113.21 22.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 121.216 -0.927 . . . . 0.0 110.771 170.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -92.2 -30.82 15.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.897 -1.127 . . . . 0.0 109.678 173.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -85.03 -44.19 13.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 123.726 0.81 . . . . 0.0 112.819 -170.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -57.97 -32.15 67.57 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.326 1.45 . . . . 0.0 113.801 177.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.1 mmm180 -52.25 -38.88 59.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 169.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.1 m-85 -75.28 -47.71 26.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.609 -1.307 . . . . 0.0 112.057 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.6 mmtp -53.88 -51.63 63.07 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.284 2.234 . . . . 0.0 112.885 177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -28.88 64.22 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.947 -1.096 . . . . 0.0 112.923 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.94 -39.67 79.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.216 -1.552 . . . . 0.0 111.939 175.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.2 -36.27 83.51 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.021 1.329 . . . . 0.0 112.066 174.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.498 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.3 t90 -72.46 -39.92 67.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.172 1.389 . . . . 0.0 113.547 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.72 -21.79 66.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.883 2.073 . . . . 0.0 114.182 176.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -64.52 -37.29 87.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.494 -2.004 . . . . 0.0 112.961 166.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.02 5.22 52.39 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.47 -1.394 . . . . 0.0 113.524 -175.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -26.61 -39.77 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.437 1 C-N-CA 131.762 4.025 . . . . 0.0 121.671 -160.807 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.92 30.32 0.33 Allowed Glycine 0 N--CA 1.43 -1.701 0 CA-C-N 120.187 1.358 . . . . 0.0 111.604 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -117.48 -61.98 1.63 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.291 -1.123 . . . . 0.0 110.34 173.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -73.15 34.82 0.08 Allowed 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 -172.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.611 HE21 ' HA ' ' A' ' 34' ' ' ALA 0.252 5.8 tm0? -68.9 -39.98 79.42 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 130.618 3.567 . . . . 0.0 109.674 152.057 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -70.06 -35.37 74.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.248 3.019 . . . . 0.0 109.847 -177.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -77.65 -48.04 17.79 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.337 1.455 . . . . 0.0 111.976 166.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 30' ' ' LEU . . . -42.65 -61.72 1.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.115 1.894 . . . . 0.0 116.115 -175.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -52.99 -23.51 7.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.057 3.355 . . . . 0.0 120.057 173.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.1 mttt -89.18 -40.91 12.56 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 118.692 -2.505 . . . . 0.0 115.042 170.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -70.06 -31.59 69.27 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 120.608 -1.308 . . . . 0.0 110.837 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -69.52 -47.34 64.09 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -166.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 3.2 tt -42.25 -50.6 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 124.513 1.125 . . . . 0.0 113.945 169.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.52 -43.39 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 95.6 mt -59.12 -45.0 92.02 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.762 -1.211 . . . . 0.0 113.156 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.773 HG13 HG11 ' A' ' 12' ' ' VAL . 27.4 t -81.99 -25.27 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.429 1.491 . . . . 0.0 111.377 -172.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.01 -29.75 69.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.186 -2.197 . . . . 0.0 113.116 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -70.17 -32.34 70.24 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.864 -1.147 . . . . 0.0 113.742 170.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD11 ' HG ' ' A' ' 27' ' ' LEU . 5.9 mt -71.28 -56.61 5.67 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.745 1.618 . . . . 0.0 110.056 173.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 50.3 mt -60.46 -34.77 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.343 1.457 . . . . 0.0 112.705 -174.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.42 -34.47 61.41 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 172.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 84' ' ' TYR . 9.0 mmpt? -87.46 -37.03 17.33 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.258 1.023 . . . . 0.0 111.184 174.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.407 ' CD1' ' HB2' ' A' ' 83' ' ' LYS . 21.9 m-30 -109.3 -14.53 14.44 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.564 1.691 . . . . 0.0 115.564 -153.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.6 t -43.52 -54.75 4.66 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.324 1.85 . . . . 0.0 115.807 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--O 1.26 1.626 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 165.099 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 CA--C 1.49 -1.343 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.6 p -56.13 -27.36 53.69 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 118.369 -2.707 . . . . 0.0 114.713 171.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -64.59 -56.72 12.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 168.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 48.1 tp -53.35 -48.9 68.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.953 2.101 . . . . 0.0 110.987 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.503 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 46.6 t80 -44.48 -47.8 10.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.017 2.527 . . . . 0.0 112.396 178.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -80.21 -29.91 38.61 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.166 -0.959 . . . . 0.0 113.535 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -66.05 -48.74 70.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.88 1.324 . . . . 0.0 112.035 173.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.497 ' HB3' HG11 ' A' ' 77' ' ' VAL . 10.9 mptt -78.32 -30.03 48.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.285 1.434 . . . . 0.0 113.17 -173.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.448 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -65.97 -45.13 82.82 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-O 123.74 1.733 . . . . 0.0 114.129 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.4 mmtm -65.02 -20.84 66.7 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.753 1.621 . . . . 0.0 113.563 175.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.21 -56.84 4.43 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.001 -1.062 . . . . 0.0 110.268 168.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.483 HG11 HG13 ' A' ' 77' ' ' VAL . 23.7 m -64.46 -26.69 40.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.476 -1.39 . . . . 0.0 114.255 -170.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -70.42 -29.55 66.18 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.024 -1.047 . . . . 0.0 113.413 173.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -122.04 27.24 8.14 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.557 1.543 . . . . 0.0 112.029 -171.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.555 HD11 HD13 ' A' ' 81' ' ' ILE . 12.5 mt -72.63 164.98 55.94 Favored Pre-proline 0 N--CA 1.429 -1.496 0 O-C-N 119.652 -1.905 . . . . 0.0 111.492 170.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.95 -28.31 6.21 Favored 'Trans proline' 0 C--N 1.3 -2.013 0 C-N-CA 122.804 2.336 . . . . 0.0 111.193 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 m -97.86 84.24 3.3 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 102.335 -3.209 . . . . 0.0 102.335 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -63.4 161.69 31.77 Favored Pre-proline 0 N--CA 1.43 -1.444 0 C-N-CA 125.513 1.525 . . . . 0.0 113.61 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_exo -65.96 142.97 70.85 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 121.99 1.746 . . . . 0.0 115.532 -164.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.9 m -70.23 148.59 48.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.772 1.229 . . . . 0.0 111.508 176.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.0 p -69.12 -34.67 75.4 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 -159.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -83.66 -22.79 32.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.418 -1.426 . . . . 0.0 112.632 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.58 -45.12 39.53 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.499 1.119 . . . . 0.0 110.606 175.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.1 tp -45.98 -35.44 4.73 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.434 2.294 . . . . 0.0 116.366 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 75.7 mt -55.19 -54.37 44.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.431 1.492 . . . . 0.0 114.97 170.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.63 -40.46 76.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.393 1.077 . . . . 0.0 112.759 177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' HD21 ' A' ' 80' ' ' LEU . 4.5 mm? -69.33 -33.89 73.8 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.745 -1.222 . . . . 0.0 113.014 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -57.59 -55.42 35.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.701 1.6 . . . . 0.0 110.548 164.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.85 -54.17 32.09 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.543 1.137 . . . . 0.0 112.363 -174.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.95 -44.9 94.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.448 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.4 t80 -57.14 -52.82 63.78 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.181 1.467 . . . . 0.0 111.445 177.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.503 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.8 mmmt -61.15 -36.9 81.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.494 -2.004 . . . . 0.0 112.912 174.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -56.86 -57.17 13.64 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.998 1.319 . . . . 0.0 114.34 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.609 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -94.13 -0.09 55.5 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.17 -0.956 . . . . 0.0 113.063 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.3 m -68.51 -60.63 2.29 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.783 -1.198 . . . . 0.0 110.381 162.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.672 HG23 ' H ' ' A' ' 38' ' ' ASP . 4.8 m -87.64 -45.56 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.228 -1.545 . . . . 0.0 114.69 -176.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 100.23 11.61 41.7 Favored Glycine 0 N--CA 1.43 -1.729 0 C-N-CA 126.153 1.835 . . . . 0.0 115.321 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.672 ' H ' HG23 ' A' ' 36' ' ' VAL . 27.8 m-20 -146.29 178.77 7.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 172.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -75.94 119.92 20.56 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.375 -1.453 . . . . 0.0 111.292 145.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.63 ' HB2' HG21 ' A' ' 36' ' ' VAL . 22.7 t0 -101.02 -80.0 0.5 Allowed 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.454 -1.404 . . . . 0.0 112.851 -168.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.28 81.77 1.36 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.114 1.766 . . . . 0.0 115.077 -168.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -79.77 61.46 3.72 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.319 1.447 . . . . 0.0 111.458 -178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -160.37 76.36 2.73 Favored Pre-proline 0 N--CA 1.43 -1.437 0 C-N-CA 125.455 1.502 . . . . 0.0 109.986 162.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -75.9 167.53 26.0 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 CA-C-N 124.098 2.499 . . . . 0.0 109.953 166.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.32 -172.86 32.03 Favored Glycine 0 N--CA 1.43 -1.737 0 CA-C-N 121.182 1.81 . . . . 0.0 115.852 -168.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.6 pt -102.32 -49.09 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 124.739 1.216 . . . . 0.0 109.568 -166.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.16 32.95 4.56 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.477 1.911 . . . . 0.0 107.71 167.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -95.41 94.29 7.73 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 120.617 -1.302 . . . . 0.0 108.364 169.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -69.61 -43.38 72.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 111.279 -176.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -59.46 -56.09 26.43 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.724 2.01 . . . . 0.0 112.802 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' HA ' ' HD2' ' A' ' 54' ' ' LYS . 21.8 m-20 -66.15 -31.06 71.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.8 mtt180 -61.07 -41.85 97.4 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.118 -1.614 . . . . 0.0 115.121 170.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -66.63 -47.75 71.62 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.104 -0.998 . . . . 0.0 113.185 173.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 51' ' ' ASP . 91.3 mttt -56.98 -46.49 82.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.306 1.443 . . . . 0.0 113.649 177.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -71.06 -31.53 67.97 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.715 -1.241 . . . . 0.0 113.119 -176.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -69.09 -37.05 78.24 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.965 -1.71 . . . . 0.0 112.182 170.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.88 -26.42 67.62 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.443 -1.41 . . . . 0.0 112.657 176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.7 t90 -80.81 -49.16 11.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.59 1.956 . . . . 0.0 111.456 177.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -55.27 -30.62 60.46 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.804 2.842 . . . . 0.0 112.781 176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -49.9 -38.15 34.56 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.159 -1.588 . . . . 0.0 115.206 167.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.9 mp -116.78 38.85 3.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 122.343 1.068 . . . . 0.0 111.263 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt -39.21 -41.78 0.9 Allowed 'General case' 0 N--CA 1.429 -1.491 1 N-CA-C 122.339 4.199 . . . . 0.0 122.339 174.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -109.43 -44.64 1.05 Allowed Glycine 0 N--CA 1.431 -1.653 0 CA-C-N 120.516 1.507 . . . . 0.0 113.476 -173.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.3 ptmm? -94.1 17.4 12.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 124.689 2.185 . . . . 0.0 112.135 -167.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.5 m -45.72 -50.59 13.6 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 131.527 3.931 . . . . 0.0 117.488 -170.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -67.28 -34.52 77.58 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 122.331 1.063 . . . . 0.0 113.186 -168.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -77.93 -45.04 25.13 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.709 2.003 . . . . 0.0 110.334 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -93.1 -14.45 27.24 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.621 -1.299 . . . . 0.0 111.603 -167.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.609 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -65.87 -62.35 1.55 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.223 -1.548 . . . . 0.0 113.451 162.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -44.57 -44.1 8.54 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 118.857 2.91 . . . . 0.0 118.857 -173.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.15 -21.34 24.67 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.319 -1.488 . . . . 0.0 113.879 -171.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -89.99 -25.76 20.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.98 -1.075 . . . . 0.0 111.193 172.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.91 -48.43 71.45 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.5 tt -39.16 -52.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 N-CA-C 116.109 1.892 . . . . 0.0 116.109 171.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.67 -20.62 56.43 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.2 mt -72.16 -56.02 6.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.33 -1.481 . . . . 0.0 110.056 167.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.497 HG11 ' HB3' ' A' ' 8' ' ' LYS . 39.0 t -68.65 -27.27 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 124.876 1.271 . . . . 0.0 111.403 -167.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -63.52 -40.43 97.03 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.029 -1.669 . . . . 0.0 113.813 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -74.05 -26.57 60.47 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.999 -1.063 . . . . 0.0 113.161 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.405 HD21 ' HG ' ' A' ' 27' ' ' LEU . 9.4 mp -66.08 -61.38 2.07 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.592 1.157 . . . . 0.0 108.587 168.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.555 HD13 HD11 ' A' ' 15' ' ' LEU . 1.9 mm -54.31 -40.41 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 126.211 1.804 . . . . 0.0 113.997 -176.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.36 -38.55 59.04 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 172.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -87.53 -39.55 15.04 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.392 -1.443 . . . . 0.0 112.966 172.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.412 ' HB3' HD13 ' A' ' 15' ' ' LEU . 3.0 m-30 -86.18 -17.54 34.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.504 -1.373 . . . . 0.0 112.63 -162.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 74.2 m -47.05 -57.42 5.06 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 117.541 2.423 . . . . 0.0 117.541 170.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 C--O 1.261 1.69 0 O-C-N 121.053 -1.029 . . . . 0.0 108.906 174.93 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.569 HG12 ' H ' ' A' ' 4' ' ' LEU . 2.3 t . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.9 m -70.64 -19.66 62.8 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.724 2.81 . . . . 0.0 113.66 169.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -68.84 -43.31 75.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.185 -2.197 . . . . 0.0 112.911 171.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.569 ' H ' HG12 ' A' ' 1' ' ' VAL . 53.4 tp -59.7 -48.79 80.28 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.312 1.445 . . . . 0.0 109.973 174.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.564 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 30.6 t80 -44.47 -49.54 9.81 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.266 1.827 . . . . 0.0 112.615 176.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -74.95 -38.44 61.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.988 -1.07 . . . . 0.0 112.635 -177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -59.23 -50.28 74.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.7 1.2 . . . . 0.0 112.511 175.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' HB3' HG11 ' A' ' 77' ' ' VAL . 0.6 OUTLIER -85.59 -25.37 26.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.623 1.169 . . . . 0.0 112.747 -174.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.473 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.31 -46.51 73.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.603 -1.936 . . . . 0.0 113.44 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -62.49 -20.02 64.17 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.649 1.179 . . . . 0.0 113.888 178.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.07 -57.24 3.95 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.594 1.158 . . . . 0.0 111.366 169.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 26.9 m -63.71 -28.41 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.555 -1.341 . . . . 0.0 113.789 -171.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.5 m-80 -72.65 -14.21 61.54 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.7 pt-20 -133.7 11.22 4.03 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.529 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 2.6 tp -66.5 150.78 97.0 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 126.625 1.97 . . . . 0.0 111.656 -176.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.529 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 56.1 Cg_endo -75.81 -14.54 19.41 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.165 2.577 . . . . 0.0 111.803 -172.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.7 m -105.27 77.79 1.33 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 102.264 -3.235 . . . . 0.0 102.264 170.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -60.66 151.15 72.73 Favored Pre-proline 0 N--CA 1.431 -1.407 0 C-N-CA 125.503 1.521 . . . . 0.0 113.663 -171.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -64.04 149.9 89.5 Favored 'Trans proline' 0 N--CA 1.434 -1.979 0 C-N-CA 122.864 2.376 . . . . 0.0 113.173 -167.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.3 m -71.02 160.69 32.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 120.693 1.588 . . . . 0.0 112.446 -177.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.0 t -57.13 -47.85 80.1 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.928 -1.732 . . . . 0.0 115.354 -171.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.0 m-20 -77.29 -26.48 52.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.43 -1.419 . . . . 0.0 112.452 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -67.67 -53.45 27.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.152 1.381 . . . . 0.0 110.635 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.3 tp -48.31 -30.48 4.91 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 127.234 2.213 . . . . 0.0 116.599 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.74 -51.34 65.37 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.458 -1.401 . . . . 0.0 114.269 172.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -80.12 -32.88 39.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.904 -1.122 . . . . 0.0 112.499 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -71.93 -26.25 62.22 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.992 -1.693 . . . . 0.0 111.751 174.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -59.91 -57.67 11.89 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.237 1.415 . . . . 0.0 109.925 161.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.95 -53.26 27.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.096 1.358 . . . . 0.0 113.79 -174.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD21 ' HB2' ' A' ' 72' ' ' GLU . 1.1 mp -65.2 -41.17 94.77 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 116.444 2.016 . . . . 0.0 116.444 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.473 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 24.7 t80 -62.24 -50.13 72.98 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-O 123.377 1.56 . . . . 0.0 111.332 178.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.441 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.8 mmmt -61.11 -33.71 73.81 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.834 -1.791 . . . . 0.0 113.077 172.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -59.48 -61.07 2.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.742 -1.224 . . . . 0.0 114.248 176.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.564 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.278 . . -86.45 -7.44 58.42 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.4 p -70.82 -55.6 8.17 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.929 2.15 . . . . 0.0 111.636 163.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 31.1 t -72.96 -58.21 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.512 -1.368 . . . . 0.0 111.469 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.9 -1.4 59.55 Favored Glycine 0 N--CA 1.43 -1.725 0 C-N-CA 126.365 1.936 . . . . 0.0 113.016 -177.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -141.87 168.46 19.71 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 176.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 46.2 p-10 -58.95 137.41 57.9 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.442 -1.411 . . . . 0.0 114.16 150.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -113.35 -86.19 0.58 Allowed 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.799 -1.813 . . . . 0.0 113.009 -171.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -84.62 86.84 7.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.562 -1.336 . . . . 0.0 111.405 -169.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -80.22 53.4 1.75 Allowed 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 123.932 1.825 . . . . 0.0 112.889 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.89 77.42 2.81 Favored Pre-proline 0 N--CA 1.43 -1.448 0 C-N-CA 127.549 2.34 . . . . 0.0 109.28 169.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -71.63 151.94 58.81 Favored 'Trans proline' 0 C--N 1.299 -2.062 0 O-C-N 117.918 -1.675 . . . . 0.0 108.264 152.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.86 172.15 51.46 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 120.469 1.486 . . . . 0.0 114.533 -170.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 2.3 pp -92.6 -40.41 12.09 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.361 0 O-C-N 120.429 -1.63 . . . . 0.0 110.575 -159.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -86.76 -2.17 58.34 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.092 1.757 . . . . 0.0 110.275 164.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -83.18 71.46 10.18 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.855 -1.153 . . . . 0.0 111.943 -173.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.6 mmt -54.1 -47.01 72.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.223 1.409 . . . . 0.0 114.156 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -64.67 -42.8 95.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.58 1.152 . . . . 0.0 113.899 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -67.91 -39.86 83.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.772 -1.205 . . . . 0.0 112.901 175.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -57.3 -43.91 83.63 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.353 -1.467 . . . . 0.0 114.68 173.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -59.52 -49.48 77.61 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.458 -1.401 . . . . 0.0 114.368 177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -72.97 -33.25 65.75 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.047 -1.033 . . . . 0.0 113.378 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -70.69 -37.36 73.59 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.771 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -69.05 -33.29 73.36 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.51 -1.994 . . . . 0.0 112.207 173.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.81 -23.77 67.34 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.725 -1.234 . . . . 0.0 112.632 174.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.441 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -83.89 -54.46 4.86 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.613 1.965 . . . . 0.0 111.139 177.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -54.76 -24.56 22.96 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 130.501 3.52 . . . . 0.0 115.035 176.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -57.07 -32.08 65.88 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 118.571 -2.58 . . . . 0.0 113.726 166.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.2 mp -116.88 41.01 2.83 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 122.458 1.123 . . . . 0.0 111.399 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -49.92 -26.81 4.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 121.763 3.986 . . . . 0.0 121.763 172.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -116.14 -44.96 0.6 Allowed Glycine 0 N--CA 1.43 -1.702 0 CA-C-N 119.365 0.984 . . . . 0.0 113.443 -172.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -96.0 16.56 17.55 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 124.089 1.9 . . . . 0.0 112.21 -171.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.04 -50.53 8.34 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 129.8 3.24 . . . . 0.0 116.939 -172.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -76.95 -10.66 59.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 -86.42 -50.27 7.02 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 174.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -29.3 16.94 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -166.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.53 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -56.06 -61.46 2.36 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.173 -0.954 . . . . 0.0 113.239 176.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -47.16 -32.17 4.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 177.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 29.1 mmtp -85.32 -33.41 22.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.921 -1.737 . . . . 0.0 114.35 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.474 ' HB2' HD21 ' A' ' 30' ' ' LEU . 5.8 mm-40 -84.97 -32.47 22.99 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.416 -1.428 . . . . 0.0 109.901 173.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -63.97 -46.67 83.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.335 -1.478 . . . . 0.0 114.363 -171.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.2 tt -39.02 -56.48 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 115.972 1.841 . . . . 0.0 115.972 167.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.57 -31.42 65.23 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.32 -55.54 17.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.246 1.018 . . . . 0.0 111.579 172.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.419 HG11 ' HB3' ' A' ' 8' ' ' LYS . 38.4 t -71.67 -24.88 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 126.133 1.773 . . . . 0.0 111.261 -170.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -65.23 -34.59 78.72 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.76 -1.838 . . . . 0.0 112.968 171.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -76.87 -26.59 54.41 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.804 -1.185 . . . . 0.0 112.842 174.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.59 -61.81 1.71 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.826 -1.171 . . . . 0.0 108.558 169.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.4 mm -57.56 -41.67 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.607 1.563 . . . . 0.0 113.777 -172.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.69 -32.53 67.44 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 176.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -87.18 -36.0 18.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.575 1.55 . . . . 0.0 110.542 173.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -103.56 -22.0 13.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.27 1.952 . . . . 0.0 116.27 -157.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.6 t -39.42 -54.99 1.84 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 175.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 p . . . . . 0 C--O 1.261 1.668 0 C-N-CA 123.848 0.859 . . . . 0.0 110.872 170.698 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.511 ' HB ' HD21 ' A' ' 4' ' ' LEU . 4.4 t . . . . . 0 CA--C 1.49 -1.34 0 CA-C-O 121.051 0.453 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 58.8 m -80.75 -2.33 46.53 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.682 -1.886 . . . . 0.0 114.011 -166.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -74.04 -60.69 2.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.451 -1.406 . . . . 0.0 110.698 179.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -62.27 -32.38 73.08 Favored 'General case' 0 N--CA 1.429 -1.524 0 C-N-CA 126.199 1.8 . . . . 0.0 111.594 178.323 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 78.0 t80 -50.03 -55.07 16.21 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.876 1.67 . . . . 0.0 111.691 175.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -77.45 -28.9 52.55 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.918 -1.114 . . . . 0.0 111.958 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.67 -45.75 91.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.584 1.154 . . . . 0.0 112.457 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.501 ' HB3' HG11 ' A' ' 77' ' ' VAL . 12.7 mptt -84.39 -26.86 28.05 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.237 -1.539 . . . . 0.0 112.99 177.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.479 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -49.68 64.75 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.986 1.851 . . . . 0.0 114.32 -178.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.33 -18.55 64.74 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 113.914 -1.494 . . . . 0.0 113.247 175.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.61 -62.32 1.49 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.379 -0.826 . . . . 0.0 110.16 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.604 HG11 HG13 ' A' ' 77' ' ' VAL . 32.4 m -63.61 -31.12 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-N 120.322 1.419 . . . . 0.0 113.825 -169.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -72.89 -10.21 59.55 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.056 -1.027 . . . . 0.0 113.465 176.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -144.55 36.57 1.19 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.654 1.216 . . . . 0.0 112.457 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.7 mt -71.7 168.82 19.03 Favored Pre-proline 0 N--CA 1.431 -1.417 0 O-C-N 119.81 -1.806 . . . . 0.0 110.969 170.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -76.23 -27.48 8.05 Favored 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 124.563 2.665 . . . . 0.0 110.756 176.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 90.2 m -106.79 75.52 1.06 Allowed 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 104.421 -2.437 . . . . 0.0 104.421 175.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -60.49 157.51 35.71 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 -177.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_exo -68.05 143.74 61.08 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 122.756 2.02 . . . . 0.0 114.668 -159.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.2 m -82.24 152.59 26.31 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.448 -0.783 . . . . 0.0 112.696 175.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.9 m -54.06 -54.21 42.45 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 117.013 2.227 . . . . 0.0 117.013 -161.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -70.23 -13.23 62.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.334 -1.479 . . . . 0.0 113.893 -176.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -87.04 -55.65 3.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.149 1.379 . . . . 0.0 107.851 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.7 tt -42.29 -45.21 4.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 128.626 2.77 . . . . 0.0 116.811 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -50.34 -56.63 10.48 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.893 1.812 . . . . 0.0 115.893 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -71.82 -35.5 69.94 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 112.688 178.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -64.63 -41.29 96.26 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.368 -1.457 . . . . 0.0 113.066 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -53.21 -50.0 65.58 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.48 1.912 . . . . 0.0 111.846 167.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.93 -46.95 75.0 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.482 HD23 ' HA ' ' A' ' 69' ' ' ALA . 4.4 mp -66.57 -49.82 65.13 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 172.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.479 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.0 t80 -51.75 -52.52 48.09 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.032 1.733 . . . . 0.0 111.379 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.0 mmmt -68.74 -25.62 64.83 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.258 -1.526 . . . . 0.0 113.034 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -63.15 -54.29 40.08 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.481 -2.012 . . . . 0.0 116.008 172.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.266 . . -93.97 -0.08 55.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.003 -1.686 . . . . 0.0 112.693 -178.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 52.0 m -71.94 -59.7 2.61 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.066 -1.646 . . . . 0.0 111.157 157.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.5 t -85.24 -61.94 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.046 -1.659 . . . . 0.0 113.351 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.99 -8.91 50.47 Favored Glycine 0 N--CA 1.43 -1.736 0 C-N-CA 126.781 2.134 . . . . 0.0 114.254 -175.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -130.92 158.66 39.63 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.827 -2.286 . . . . 0.0 104.827 170.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -59.33 120.44 9.28 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.646 -1.909 . . . . 0.0 113.512 151.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -93.18 -81.27 0.36 Allowed 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.102 -1.624 . . . . 0.0 113.125 -165.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -78.94 86.58 4.81 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.077 1.351 . . . . 0.0 113.176 -169.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -78.8 48.89 0.85 Allowed 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.476 1.911 . . . . 0.0 112.409 -175.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -160.31 86.8 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.433 0 C-N-CA 128.053 2.541 . . . . 0.0 107.407 168.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -72.71 159.93 47.48 Favored 'Trans proline' 0 N--CA 1.434 -2.015 0 C-N-CA 122.269 1.979 . . . . 0.0 108.776 157.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.23 -160.95 12.7 Favored Glycine 0 N--CA 1.431 -1.696 0 N-CA-C 117.737 1.855 . . . . 0.0 117.737 -165.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 28.8 pt -100.13 -50.39 10.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.24 -1.153 . . . . 0.0 111.194 -161.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -94.67 -1.58 52.84 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.158 1.783 . . . . 0.0 110.146 169.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -77.54 69.83 3.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.573 1.549 . . . . 0.0 115.075 -169.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.2 mmt -54.62 -46.8 73.95 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 125.81 1.644 . . . . 0.0 114.251 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -61.7 -45.14 95.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -61.23 -41.77 97.45 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.705 -1.247 . . . . 0.0 114.107 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.8 mtp85 -62.37 -40.24 95.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -62.05 -52.6 63.29 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.0 -1.688 . . . . 0.0 113.79 171.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.1 ptmt -69.6 -30.66 68.46 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.334 -1.479 . . . . 0.0 113.78 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -71.01 -33.0 69.93 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.988 -1.695 . . . . 0.0 112.799 173.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -68.48 -34.95 76.83 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.524 -1.985 . . . . 0.0 112.235 171.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.86 -28.33 68.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.346 -1.471 . . . . 0.0 112.654 175.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.508 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.7 t90 -79.03 -39.09 34.92 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.193 1.797 . . . . 0.0 112.277 175.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -66.29 -14.41 61.96 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.888 1.675 . . . . 0.0 113.636 175.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -74.04 -16.4 61.05 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 117.744 -3.098 . . . . 0.0 113.807 165.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 61.5 mt -110.95 -14.68 13.91 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.968 -1.708 . . . . 0.0 113.814 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . 0.259 0.3 OUTLIER -27.69 -32.93 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 2 N-CA-C 124.41 4.967 . . . . 0.0 124.41 -154.525 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -143.82 15.03 2.19 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 121.139 1.79 . . . . 0.0 110.839 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.2 ttmt -109.85 -61.48 1.64 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 123.333 1.54 . . . . 0.0 108.719 -178.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 58.7 m -87.52 43.36 1.1 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.809 -1.087 . . . . 0.0 113.571 -159.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -76.02 -37.32 58.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.9 1.68 . . . . 0.0 107.22 157.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -68.47 -26.53 65.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 128.758 2.823 . . . . 0.0 111.587 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 47.1 m-20 -86.93 -48.42 8.17 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.904 1.281 . . . . 0.0 111.739 165.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.482 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -42.63 -59.69 1.82 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 179.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.0 -29.35 3.39 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 119.549 3.166 . . . . 0.0 119.549 173.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -89.59 -61.16 1.76 Allowed 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.301 -2.124 . . . . 0.0 113.66 172.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -70.06 -18.72 63.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.435 1.094 . . . . 0.0 111.886 -169.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.14 -51.87 66.14 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.111 -0.993 . . . . 0.0 112.562 177.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.415 ' HB ' HD12 ' A' ' 4' ' ' LEU . 10.5 tt -59.46 -32.75 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 N-CA-C 116.015 1.858 . . . . 0.0 116.015 176.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -65.98 -36.73 84.11 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.016 -1.678 . . . . 0.0 114.795 175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.8 mt -69.62 -44.24 71.08 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.671 -1.268 . . . . 0.0 112.199 171.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.604 HG13 HG11 ' A' ' 12' ' ' VAL . 24.2 t -69.37 -25.12 28.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.804 2.041 . . . . 0.0 110.844 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -62.74 -37.4 86.41 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.846 -1.784 . . . . 0.0 112.981 170.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 16.7 mm-40 -75.05 -19.05 60.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.353 1.061 . . . . 0.0 113.335 175.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -75.36 -60.26 2.38 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.74 1.616 . . . . 0.0 108.823 169.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.0 mm -53.44 -36.74 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 C-N-CA 128.458 2.703 . . . . 0.0 113.661 -179.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.21 -35.05 34.66 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 172.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -87.77 -50.99 6.11 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.81 -1.182 . . . . 0.0 112.092 163.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.6 m-30 -89.81 -13.99 35.43 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 115.692 1.738 . . . . 0.0 115.692 -150.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.0 t -48.3 -54.83 12.37 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.007 1.723 . . . . 0.0 114.111 176.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.0 p . . . . . 0 C--O 1.26 1.645 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 172.79 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.9 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.4 t -86.68 6.8 29.41 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 129.645 3.178 . . . . 0.0 114.613 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -65.99 -54.44 26.14 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 118.874 -2.391 . . . . 0.0 110.901 174.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -63.29 -35.65 81.06 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.571 2.748 . . . . 0.0 111.746 179.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 64.4 t80 -52.46 -55.59 20.86 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.05 1.74 . . . . 0.0 110.157 175.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -74.75 -33.95 62.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.068 -1.02 . . . . 0.0 112.807 178.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.15 85.34 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.961 1.704 . . . . 0.0 112.401 -179.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.41 ' HB3' HG11 ' A' ' 77' ' ' VAL . 39.5 mmtm -90.91 -33.05 15.77 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.345 -1.472 . . . . 0.0 114.6 170.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.05 -41.92 98.64 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 118.981 -2.324 . . . . 0.0 114.583 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -67.09 -16.07 64.11 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 124.419 1.088 . . . . 0.0 112.473 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.99 -54.18 6.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.628 -1.295 . . . . 0.0 111.987 163.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.455 HG11 HG13 ' A' ' 77' ' ' VAL 0.253 1.9 m -65.92 -26.6 38.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.502 0 O-C-N 120.312 -1.492 . . . . 0.0 113.598 -172.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -68.35 -10.74 57.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 176.21 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -155.78 47.74 0.5 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.113 1.435 . . . . 0.0 110.544 171.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.89 154.81 94.51 Favored Pre-proline 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 0.0 110.808 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -78.64 -19.08 11.6 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 CA-C-N 124.584 2.673 . . . . 0.0 111.364 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 m -115.68 77.48 1.09 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 101.075 -3.676 . . . . 0.0 101.075 173.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.5 mtpt -53.0 148.85 13.12 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -173.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 91.9 Cg_exo -58.74 147.26 88.98 Favored 'Trans proline' 0 N--CA 1.433 -2.066 0 C-N-CA 124.074 3.183 . . . . 0.0 113.62 -174.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 8.7 t -73.59 167.69 20.82 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.031 1.287 . . . . 0.0 113.383 -168.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.3 t -59.75 -42.92 94.3 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.552 1.686 . . . . 0.0 115.552 -164.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -85.09 -18.42 34.34 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.586 1.154 . . . . 0.0 112.905 173.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -76.67 -48.28 19.47 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 110.966 -177.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.5 tp -45.46 -27.02 0.64 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 129.289 3.036 . . . . 0.0 116.808 178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.7 mt -79.44 -49.55 12.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.829 2.452 . . . . 0.0 113.37 177.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -65.5 -39.7 92.19 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.138 -1.601 . . . . 0.0 112.858 171.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.781 1.633 . . . . 0.0 111.888 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -59.72 -56.49 21.25 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.213 1.405 . . . . 0.0 111.518 165.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.29 -44.46 65.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 114.398 1.258 . . . . 0.0 114.398 -175.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.08 -41.95 60.91 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.516 1.673 . . . . 0.0 115.516 175.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -62.16 -50.45 71.79 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.229 -1.544 . . . . 0.0 111.195 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.421 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 23.5 mmmt -57.14 -38.81 74.04 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.974 -1.704 . . . . 0.0 113.023 169.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -52.11 -61.65 2.13 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 120.243 1.383 . . . . 0.0 114.655 176.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.524 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.268 . . -87.69 -13.06 43.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 118.764 -1.175 . . . . 0.0 113.627 -176.816 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.5 m -65.0 -59.13 4.49 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.368 1.44 . . . . 0.0 112.574 170.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.3 m -88.12 -31.35 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 120.372 -1.455 . . . . 0.0 114.3 178.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.19 -6.52 61.72 Favored Glycine 0 N--CA 1.431 -1.691 0 O-C-N 119.535 -1.978 . . . . 0.0 116.405 170.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -143.35 172.36 12.87 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -61.41 92.68 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.9 -1.125 . . . . 0.0 113.433 153.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -85.34 -64.34 1.17 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.823 -1.798 . . . . 0.0 114.626 -163.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -90.03 81.65 6.2 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.006 -1.684 . . . . 0.0 111.99 -170.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -72.38 21.51 0.06 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.071 2.148 . . . . 0.0 116.509 -165.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -149.64 96.22 3.63 Favored Pre-proline 0 N--CA 1.429 -1.492 0 C-N-CA 126.722 2.009 . . . . 0.0 107.096 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -75.68 -179.0 4.71 Favored 'Trans proline' 0 N--CA 1.433 -2.059 0 C-N-CA 122.734 2.29 . . . . 0.0 110.836 163.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.6 179.97 32.72 Favored Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.548 -1.345 . . . . 0.0 113.7 -176.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 15.0 pt -95.42 -44.38 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 121.084 -1.245 . . . . 0.0 108.207 -165.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -102.37 9.81 39.52 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.731 1.612 . . . . 0.0 109.796 171.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -75.83 87.08 2.82 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 121.129 -0.982 . . . . 0.0 111.107 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.4 tpt -70.95 -26.33 63.13 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.708 1.603 . . . . 0.0 112.701 -169.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.36 -58.48 3.26 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.281 -1.512 . . . . 0.0 111.83 172.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -63.94 -29.95 71.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -174.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -53.9 -35.49 61.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.192 1.553 . . . . 0.0 115.192 170.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -87.49 -46.84 9.24 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.459 -1.401 . . . . 0.0 111.929 173.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -81.41 -16.73 51.27 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.758 -1.839 . . . . 0.0 114.097 -167.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -71.42 -31.56 67.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.932 -1.73 . . . . 0.0 110.78 164.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -70.65 -28.27 64.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.429 -2.044 . . . . 0.0 112.397 171.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.62 -18.3 64.28 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.316 -1.49 . . . . 0.0 113.604 169.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.421 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 11.3 t90 -88.38 -52.47 5.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.313 1.845 . . . . 0.0 109.873 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -11.38 37.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.874 -1.766 . . . . 0.0 115.057 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -50.2 -36.52 31.02 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.192 -1.567 . . . . 0.0 113.109 161.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.27 40.85 2.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.462 1.505 . . . . 0.0 112.283 175.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.4 pttm -34.57 -41.3 0.12 Allowed 'General case' 0 N--CA 1.431 -1.423 1 N-CA-C 123.611 4.671 . . . . 0.0 123.611 171.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -137.1 -15.01 0.82 Allowed Glycine 0 N--CA 1.429 -1.78 0 CA-C-N 121.438 1.927 . . . . 0.0 113.241 -165.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -102.27 17.96 22.13 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 124.599 2.142 . . . . 0.0 109.43 178.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.3 m -52.21 -52.05 54.62 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.783 2.833 . . . . 0.0 116.092 -176.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -76.74 -10.45 59.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.199 -1.563 . . . . 0.0 113.92 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -89.93 -40.65 12.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 123.717 0.807 . . . . 0.0 110.228 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -93.18 -45.7 7.75 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.912 -1.117 . . . . 0.0 113.417 -175.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -55.16 -50.3 69.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -174.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -41.95 -43.14 3.02 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.702 2.482 . . . . 0.0 117.702 171.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -88.83 -44.97 10.11 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.344 1.857 . . . . 0.0 111.55 -174.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.16 -24.51 59.41 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.921 -1.112 . . . . 0.0 112.59 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.447 ' CE2' HG21 ' A' ' 77' ' ' VAL . 30.9 t80 -67.86 -53.41 26.95 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.002 0.921 . . . . 0.0 112.875 -179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.1 tt -50.4 -36.3 13.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 116.94 2.2 . . . . 0.0 116.94 175.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.97 -37.25 81.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.654 -1.904 . . . . 0.0 114.786 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 63.2 mt -66.87 -47.99 70.18 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.569 -1.332 . . . . 0.0 111.863 172.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.455 HG13 HG11 ' A' ' 12' ' ' VAL . 50.5 t -73.66 -24.29 19.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.581 1.552 . . . . 0.0 111.436 -171.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.93 -35.0 76.29 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.309 -2.119 . . . . 0.0 112.757 170.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.9 mt-30 -69.55 -31.69 70.05 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.309 -1.495 . . . . 0.0 112.394 173.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -68.08 -63.6 1.03 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.599 1.959 . . . . 0.0 109.247 174.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 49.6 mt -68.1 -30.14 46.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 120.389 -1.444 . . . . 0.0 113.432 -168.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.16 -29.88 58.7 Favored 'General case' 0 N--CA 1.429 -1.483 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -87.73 -47.54 8.56 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.659 -1.276 . . . . 0.0 111.847 167.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -98.67 -7.68 27.47 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.361 1.465 . . . . 0.0 114.699 -152.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 46.2 t -46.54 -54.92 8.39 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.967 1.707 . . . . 0.0 114.868 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.26 1.634 0 C-N-CA 124.1 0.96 . . . . 0.0 109.522 167.139 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 CA--C 1.49 -1.333 0 CA-C-O 122.277 1.036 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.4 m -52.65 -28.39 21.35 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 130.451 3.5 . . . . 0.0 115.328 177.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -74.99 -48.29 24.89 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.573 -1.329 . . . . 0.0 111.118 177.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 66.2 tp -56.93 -46.33 82.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.466 1.506 . . . . 0.0 111.308 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.524 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 0.2 OUTLIER -43.73 -53.1 6.11 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.909 2.084 . . . . 0.0 112.278 -175.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -87.38 -31.17 20.25 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.286 -0.884 . . . . 0.0 110.965 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -58.96 -42.73 90.61 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.379 1.072 . . . . 0.0 113.008 174.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.411 ' HB3' HG11 ' A' ' 77' ' ' VAL . 0.5 OUTLIER -90.89 -21.75 21.25 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 125.126 1.371 . . . . 0.0 113.148 177.118 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.4 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -65.84 -47.18 75.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.268 -2.145 . . . . 0.0 113.136 171.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -65.28 -18.61 65.45 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 175.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.68 -59.17 2.89 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 123.496 0.719 . . . . 0.0 110.355 167.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.408 HG11 HG13 ' A' ' 77' ' ' VAL . 35.9 m -61.83 -30.72 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 O-C-N 120.545 -1.347 . . . . 0.0 113.308 -171.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -69.17 -23.0 63.88 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -130.77 33.66 4.2 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 123.744 0.817 . . . . 0.0 111.933 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.3 mt -74.11 158.37 85.73 Favored Pre-proline 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 0.0 110.238 172.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -75.51 -24.37 12.1 Favored 'Trans proline' 0 C--N 1.299 -2.041 0 C-N-CA 122.752 2.302 . . . . 0.0 110.848 -176.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 93.1 m -100.71 83.24 2.54 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 102.671 -3.085 . . . . 0.0 102.671 169.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -61.09 155.13 57.21 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 126.6 1.96 . . . . 0.0 113.644 -173.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -61.6 142.29 94.12 Favored 'Trans proline' 0 C--N 1.299 -2.059 0 C-N-CA 122.931 2.421 . . . . 0.0 115.084 -168.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.1 m -76.65 159.07 30.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 177.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.6 t -61.98 -37.79 86.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -160.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -90.31 -23.76 21.07 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.669 -1.894 . . . . 0.0 112.854 178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -72.16 -50.56 26.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.921 2.089 . . . . 0.0 110.374 -176.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 35.0 tp -42.06 -38.78 1.75 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.522 2.329 . . . . 0.0 116.465 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.474 HD22 ' HG2' ' A' ' 54' ' ' LYS . 25.3 mt -72.72 -45.25 59.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.147 2.179 . . . . 0.0 114.908 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -62.44 -39.86 94.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.395 1.878 . . . . 0.0 111.514 172.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.62 -28.61 40.94 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.652 1.981 . . . . 0.0 112.671 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -52.2 -55.05 23.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.138 2.175 . . . . 0.0 110.334 167.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.43 -53.12 31.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.638 0.775 . . . . 0.0 112.904 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.41 -43.63 93.8 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 174.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.4 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.7 t80 -56.85 -57.18 13.59 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.323 -1.486 . . . . 0.0 111.142 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -57.05 -37.01 71.18 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.697 1.999 . . . . 0.0 113.6 174.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 44.5 mt-30 -53.3 -59.85 4.04 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.361 0.982 . . . . 0.0 113.314 174.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.524 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -86.06 -10.0 55.75 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.117 -0.989 . . . . 0.0 113.33 -176.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 48.0 m -66.21 -59.44 3.75 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.17 -0.956 . . . . 0.0 111.706 170.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.401 HG21 ' HB2' ' A' ' 40' ' ' ASP . 1.3 p -87.42 -56.72 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.354 -1.466 . . . . 0.0 114.631 174.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.84 -9.81 23.34 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 115.762 1.065 . . . . 0.0 115.762 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -132.64 163.46 28.87 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 172.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -67.78 79.59 0.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.043 -1.661 . . . . 0.0 114.343 162.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.401 ' HB2' HG21 ' A' ' 36' ' ' VAL . 32.8 t0 -77.57 -54.74 6.04 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.304 -2.123 . . . . 0.0 115.296 -161.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.8 mmpt? -87.11 81.72 7.93 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.031 -1.668 . . . . 0.0 112.982 -171.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -83.69 51.61 2.06 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.063 1.887 . . . . 0.0 110.657 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.0 tttp -155.65 84.36 3.48 Favored Pre-proline 0 N--CA 1.429 -1.494 0 C-N-CA 127.787 2.435 . . . . 0.0 107.629 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.53 -165.8 0.35 Allowed 'Trans proline' 0 C--N 1.3 -2.002 0 C-N-CA 123.254 2.636 . . . . 0.0 110.63 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.29 -176.61 44.75 Favored Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 121.676 2.034 . . . . 0.0 114.636 -179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.3 pt -98.93 -52.36 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 121.346 -1.09 . . . . 0.0 108.777 -171.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -94.53 5.27 52.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.464 1.506 . . . . 0.0 110.921 175.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -64.92 121.36 14.46 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 121.256 -0.903 . . . . 0.0 112.54 -174.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 99.3 mmm -85.11 -36.95 20.8 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.686 -1.259 . . . . 0.0 111.289 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -76.4 -53.38 8.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.368 1.467 . . . . 0.0 112.543 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -56.76 -37.45 71.07 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -171.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -51.63 -43.26 62.52 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.703 1.742 . . . . 0.0 115.703 176.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.261 51.5 p90 -87.49 -39.08 15.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.333 -1.48 . . . . 0.0 113.682 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.474 ' HG2' HD22 ' A' ' 25' ' ' LEU 0.325 0.0 OUTLIER -84.14 -16.35 43.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 -178.587 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 49.6 t90 -70.45 -34.0 71.94 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.667 -1.896 . . . . 0.0 110.182 162.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -77.54 -20.06 54.74 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.468 -2.02 . . . . 0.0 112.456 176.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.58 -24.23 61.87 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.928 -1.732 . . . . 0.0 112.909 166.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.42 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 12.2 t90 -80.49 -47.36 14.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.373 1.869 . . . . 0.0 108.35 175.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -53.3 -21.27 5.29 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.716 2.806 . . . . 0.0 114.31 171.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -68.29 -24.67 64.89 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 118.675 -2.516 . . . . 0.0 113.169 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 5.1 mp -116.94 19.2 14.46 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.066 -1.021 . . . . 0.0 112.92 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -27.74 -35.39 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 1 N-CA-C 122.693 4.331 . . . . 0.0 122.693 -178.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -124.61 -27.62 1.27 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.266 1.413 . . . . 0.0 114.452 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.0 ptmm? -92.06 -5.8 52.18 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.249 -1.736 . . . . 0.0 112.887 -175.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 37.8 m -26.3 -63.3 0.07 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 131.178 3.791 . . . . 0.0 117.36 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -15.31 63.53 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 -166.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -93.04 -40.3 10.6 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.613 1.165 . . . . 0.0 111.837 172.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -92.75 -31.18 15.16 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.172 -1.58 . . . . 0.0 113.387 -168.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.506 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -53.07 -62.51 1.61 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.032 1.333 . . . . 0.0 112.69 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -42.21 -44.74 3.87 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -87.16 -25.38 24.11 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.009 -1.682 . . . . 0.0 113.726 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -79.07 -35.47 42.39 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.553 -1.342 . . . . 0.0 110.343 169.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -58.84 -50.88 72.32 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 115.56 1.689 . . . . 0.0 115.56 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 15.4 tt -38.61 -52.98 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 172.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.8 -21.44 51.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 73.9 mt -74.53 -50.26 18.81 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.61 -1.306 . . . . 0.0 111.154 169.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 8' ' ' LYS . 37.6 t -67.41 -23.4 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.308 1.843 . . . . 0.0 110.712 -174.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -46.37 81.01 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.451 -1.406 . . . . 0.0 113.745 166.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -74.72 -26.1 59.58 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.274 1.83 . . . . 0.0 113.451 177.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 7.0 mp -64.92 -59.73 3.85 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.413 -1.429 . . . . 0.0 107.767 168.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.15 -34.17 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 C-N-CA 125.244 1.418 . . . . 0.0 114.467 -173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -54.27 -31.92 54.91 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.661 1.356 . . . . 0.0 114.661 171.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -87.4 -49.71 7.05 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.744 -1.222 . . . . 0.0 110.223 168.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 23.2 m-30 -93.79 -10.79 33.0 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.508 1.669 . . . . 0.0 115.508 -152.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.8 t -57.64 -56.02 27.27 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.616 -1.302 . . . . 0.0 114.36 176.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 C--O 1.26 1.644 0 O-C-N 121.467 -0.77 . . . . 0.0 108.976 172.759 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.425 HG23 ' HB3' ' A' ' 4' ' ' LEU . 2.3 m . . . . . 0 CA--C 1.491 -1.314 0 N-CA-C 114.725 1.38 . . . . 0.0 114.725 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 m -71.85 -23.82 61.59 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 128.537 2.735 . . . . 0.0 113.989 -177.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -72.6 -46.89 52.0 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.436 -1.415 . . . . 0.0 112.138 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.425 ' HB3' HG23 ' A' ' 1' ' ' VAL . 62.8 tp -61.87 -43.43 98.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.33 1.452 . . . . 0.0 111.303 178.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 31.7 t80 -44.44 -48.85 9.97 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.748 2.019 . . . . 0.0 112.585 174.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -83.41 -27.4 29.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.945 -1.097 . . . . 0.0 112.961 -176.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 22.2 tp10 -61.7 -53.59 54.03 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.877 -1.139 . . . . 0.0 112.039 169.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -86.01 -21.54 27.74 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.017 -1.677 . . . . 0.0 114.579 -173.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.48 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -64.64 -47.47 78.41 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 124.351 2.024 . . . . 0.0 113.596 176.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt -60.96 -22.04 64.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.628 1.971 . . . . 0.0 113.367 173.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.48 -58.37 3.33 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.27 1.028 . . . . 0.0 110.731 168.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 m -64.41 -26.69 40.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 119.972 -1.705 . . . . 0.0 114.241 -172.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -76.26 -11.01 59.84 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 175.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -128.13 -2.79 5.73 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.946 1.299 . . . . 0.0 112.593 -171.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.495 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 tp -68.46 150.5 97.67 Favored Pre-proline 0 N--CA 1.43 -1.432 0 O-C-N 119.327 -2.108 . . . . 0.0 111.713 -174.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.495 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 81.4 Cg_endo -74.79 -10.9 21.81 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 C-N-CA 123.876 3.051 . . . . 0.0 112.182 -172.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 55.0 m -109.63 80.1 1.28 Allowed 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 102.72 -3.067 . . . . 0.0 102.72 164.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -58.96 145.0 81.09 Favored Pre-proline 0 N--CA 1.429 -1.482 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.847 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -67.79 157.25 62.63 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.531 2.154 . . . . 0.0 113.904 -153.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.1 t -72.48 135.42 45.69 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.762 -1.212 . . . . 0.0 111.243 176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 5.6 t -53.56 -36.89 62.35 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.119 2.266 . . . . 0.0 117.119 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -68.01 -41.99 81.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.231 1.812 . . . . 0.0 112.912 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.58 -48.8 65.82 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.263 1.425 . . . . 0.0 110.12 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.0 tt -48.75 -37.8 19.95 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.754 2.422 . . . . 0.0 116.473 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.91 -57.94 6.44 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 167.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -67.71 -40.95 84.22 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.597 1.159 . . . . 0.0 111.159 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.09 -31.46 70.19 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.122 1.769 . . . . 0.0 113.247 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.66 -54.82 33.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.755 1.622 . . . . 0.0 108.724 168.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.21 -48.1 65.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 69' ' ' ALA . 0.4 OUTLIER -65.13 -46.43 81.01 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.719 1.748 . . . . 0.0 115.719 174.307 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.48 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 21.4 t80 -55.88 -50.55 70.34 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.119 1.437 . . . . 0.0 111.051 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 25.2 mmmt -64.23 -36.86 85.44 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.359 -1.463 . . . . 0.0 112.866 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.439 ' NE2' HD13 ' A' ' 61' ' ' LEU . 22.1 mt-30 -53.24 -60.07 3.76 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.883 1.219 . . . . 0.0 113.914 176.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -93.67 -0.29 56.14 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.083 -1.01 . . . . 0.0 113.668 -176.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.9 m -69.41 -64.34 0.89 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.278 -1.514 . . . . 0.0 111.502 161.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.84 -45.49 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.676 -1.265 . . . . 0.0 114.17 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 108.14 -31.53 7.83 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.084 -1.635 . . . . 0.0 113.69 -175.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.66 164.88 26.52 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.345 1.058 . . . . 0.0 108.799 -175.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -48.32 103.61 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 157.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -92.36 -81.36 0.34 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.67 1.188 . . . . 0.0 111.046 -175.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.7 81.7 8.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.002 1.721 . . . . 0.0 111.93 -171.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -83.26 64.76 7.92 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.907 1.813 . . . . 0.0 110.023 177.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.1 tttt -159.26 68.42 3.21 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 127.187 2.195 . . . . 0.0 107.453 171.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.82 152.92 47.7 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.688 2.353 . . . . 0.0 107.554 158.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.47 -170.22 33.98 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.56 -1.962 . . . . 0.0 114.934 -168.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.3 pt -102.46 -47.11 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.651 -1.499 . . . . 0.0 109.513 -162.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -84.65 -7.64 59.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.95 2.1 . . . . 0.0 109.917 167.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -76.67 70.35 3.16 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.566 1.146 . . . . 0.0 113.216 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -58.18 -33.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.013 2.125 . . . . 0.0 113.958 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -66.52 -62.31 1.53 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.104 1.362 . . . . 0.0 111.717 175.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.68 -32.55 65.53 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -50.99 -50.71 57.8 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 169.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.286 17.1 p90 -74.02 -36.39 64.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.42 -1.425 . . . . 0.0 113.921 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -53.25 -50.24 65.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.739 1.216 . . . . 0.0 112.873 171.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -73.41 -33.75 65.12 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.083 0.953 . . . . 0.0 113.342 -177.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -69.7 -38.09 76.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.02 -1.675 . . . . 0.0 111.914 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -70.98 -17.83 62.63 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.99 1.316 . . . . 0.0 112.974 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -88.89 -44.88 10.14 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.84 1.656 . . . . 0.0 109.103 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -57.41 -16.62 9.77 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.557 2.343 . . . . 0.0 113.681 175.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -67.08 -26.03 66.52 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.146 -2.846 . . . . 0.0 114.21 170.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.439 HD13 ' NE2' ' A' ' 33' ' ' GLN . 0.9 OUTLIER -117.26 10.68 13.83 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.469 -1.394 . . . . 0.0 111.938 -175.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.84 -1.43 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.487 2 C-N-CA 134.904 5.282 . . . . 0.0 123.555 -172.256 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -168.5 4.91 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.734 0 O-C-N 119.491 -2.006 . . . . 0.0 111.803 173.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -106.77 -55.89 2.27 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.462 1.601 . . . . 0.0 108.178 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 67.5 m -86.53 34.15 0.64 Allowed 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.748 -1.569 . . . . 0.0 114.712 -161.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -55.01 -33.08 62.3 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.962 -1.712 . . . . 0.0 111.923 150.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -72.35 -49.01 37.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 129.678 3.191 . . . . 0.0 112.209 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -42.54 53.03 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.633 -0.667 . . . . 0.0 112.731 176.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -42.44 -62.38 0.98 Allowed 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.52 -28.23 8.12 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 120.108 3.374 . . . . 0.0 120.108 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 mmtt -88.85 -38.76 14.34 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.912 2.085 . . . . 0.0 113.386 179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -87.46 -23.5 24.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.318 -1.489 . . . . 0.0 111.265 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.435 ' CE2' HG21 ' A' ' 77' ' ' VAL . 18.6 t80 -65.61 -48.5 72.08 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.239 -1.538 . . . . 0.0 113.82 -176.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 11.9 tt -38.79 -54.26 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.405 0 N-CA-C 115.868 1.803 . . . . 0.0 115.868 167.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.01 -18.14 58.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 46.3 mt -76.71 -53.58 7.79 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.822 -1.799 . . . . 0.0 110.447 168.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.435 HG21 ' CE2' ' A' ' 73' ' ' TYR . 40.9 t -69.53 -26.79 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.611 1.964 . . . . 0.0 112.017 -168.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.31 -38.15 90.02 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 0.0 112.913 170.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 21.9 mm-40 -80.29 -16.04 55.56 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.379 1.071 . . . . 0.0 113.22 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.2 mp -70.76 -62.2 1.48 Allowed 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.686 . . . . 0.0 107.941 164.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.8 mt -61.27 -33.0 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 125.346 1.458 . . . . 0.0 113.517 -173.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -52.82 -37.36 59.85 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 171.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -86.96 -45.41 10.82 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.92 -1.113 . . . . 0.0 110.436 169.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.5 m-30 -90.36 -12.79 36.6 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.83 1.419 . . . . 0.0 114.83 -153.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.4 p -43.98 -54.84 5.07 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.1 p . . . . . 0 C--O 1.26 1.63 0 O-C-N 120.888 -1.132 . . . . 0.0 110.755 170.14 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.3 m . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.711 0.767 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 t -73.93 -18.58 60.88 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.825 -1.797 . . . . 0.0 113.408 -174.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -78.72 -45.94 20.09 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.858 -1.776 . . . . 0.0 112.266 171.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.4 tp -63.24 -37.03 85.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.691 -1.256 . . . . 0.0 110.645 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.59 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 73.9 t80 -44.24 -46.69 9.14 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.906 1.682 . . . . 0.0 112.276 172.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -81.09 -41.86 21.88 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.868 -1.145 . . . . 0.0 111.946 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.8 -46.31 78.03 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.672 1.189 . . . . 0.0 112.907 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -88.34 -28.02 21.27 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -178.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.46 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -67.4 -48.09 68.37 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.307 -2.12 . . . . 0.0 113.552 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -67.03 -15.8 63.95 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.112 0.965 . . . . 0.0 113.39 173.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.4 -54.21 8.86 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.121 -0.987 . . . . 0.0 111.265 166.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.512 ' HA ' HD22 ' A' ' 15' ' ' LEU . 26.8 m -68.23 -33.04 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.741 1.216 . . . . 0.0 113.699 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -77.64 -6.22 53.06 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.9 -1.125 . . . . 0.0 113.544 176.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -121.35 2.38 10.26 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.552 1.141 . . . . 0.0 112.642 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 84' ' ' TYR . 1.7 tp -71.45 156.18 91.82 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 119.398 -2.064 . . . . 0.0 112.18 -167.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 84.6 Cg_endo -75.26 -21.49 15.32 Favored 'Trans proline' 0 N--CA 1.433 -2.036 0 CA-C-N 123.981 2.458 . . . . 0.0 111.017 -177.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.5 m -96.22 63.15 2.19 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 173.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 45.9 mttm -51.53 144.32 17.73 Favored Pre-proline 0 N--CA 1.429 -1.505 0 C-N-CA 127.856 2.462 . . . . 0.0 114.163 -170.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo -59.21 136.76 74.74 Favored 'Trans proline' 0 N--CA 1.434 -2.022 0 CA-C-N 124.426 2.616 . . . . 0.0 118.228 -153.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 m -77.61 147.64 35.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.902 1.281 . . . . 0.0 111.95 -174.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.26 12.3 t -62.1 -45.79 91.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 117.223 2.305 . . . . 0.0 117.223 -158.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -74.68 -28.4 60.81 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.76 -1.837 . . . . 0.0 112.717 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -76.81 -44.14 33.72 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.713 1.605 . . . . 0.0 110.979 -176.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -47.75 -38.78 16.22 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.999 2.52 . . . . 0.0 116.068 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.9 -45.12 87.29 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.919 1.822 . . . . 0.0 115.919 176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -66.79 -44.95 79.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.696 1.199 . . . . 0.0 110.399 173.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.76 -42.34 97.26 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.286 2.234 . . . . 0.0 113.539 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -49.58 -55.48 13.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.826 2.45 . . . . 0.0 111.716 171.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.47 -50.29 32.09 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 178.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.487 HD12 ' HA ' ' A' ' 69' ' ' ALA . 2.7 mm? -77.4 -38.72 49.26 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -177.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.46 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 26.0 t80 -61.31 -56.31 21.91 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.866 -1.771 . . . . 0.0 111.299 175.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.445 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 25.5 mmmt -57.66 -40.12 78.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.523 -1.986 . . . . 0.0 112.816 176.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.435 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . 20.8 mt-30 -46.15 -61.57 1.71 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.94 1.83 . . . . 0.0 115.94 171.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.697 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -85.44 -14.64 45.55 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.783 -1.198 . . . . 0.0 112.718 -175.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 43.0 m -60.3 -60.26 4.1 Favored 'General case' 0 N--CA 1.43 -1.445 0 CA-C-N 119.227 0.922 . . . . 0.0 112.188 171.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.06 -47.16 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.905 -1.122 . . . . 0.0 113.104 178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.85 4.83 45.17 Favored Glycine 0 N--CA 1.43 -1.731 0 O-C-N 121.105 -0.997 . . . . 0.0 114.607 -177.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -144.51 169.09 18.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -72.94 88.59 1.37 Allowed 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 123.185 1.469 . . . . 0.0 112.641 158.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -72.83 -75.54 0.14 Allowed 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.199 -1.563 . . . . 0.0 113.862 -175.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.6 ttmm -86.45 81.39 8.33 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.211 2.671 . . . . 0.0 118.211 -150.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -81.45 36.81 0.44 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.926 2.09 . . . . 0.0 112.046 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -127.08 71.27 75.73 Favored Pre-proline 0 N--CA 1.43 -1.442 0 C-N-CA 126.411 1.885 . . . . 0.0 108.84 166.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -84.25 -158.84 0.09 OUTLIER 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 123.191 2.594 . . . . 0.0 111.273 174.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.37 -178.53 47.91 Favored Glycine 0 N--CA 1.429 -1.81 0 CA-C-N 121.881 2.128 . . . . 0.0 114.561 175.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.5 pt -105.28 -47.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 121.44 -1.035 . . . . 0.0 109.284 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.89 33.32 4.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.369 1.868 . . . . 0.0 110.617 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -82.71 146.35 29.09 Favored 'General case' 0 N--CA 1.429 -1.504 0 O-C-N 119.177 -2.202 . . . . 0.0 110.388 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.2 tpt -98.67 -35.58 10.14 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.175 -1.578 . . . . 0.0 108.998 170.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 mttp -74.34 -31.89 62.59 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 -175.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -35.1 76.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.898 -1.751 . . . . 0.0 113.746 176.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.9 mmt85 -60.06 -21.1 60.99 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.294 2.238 . . . . 0.0 113.75 173.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -91.41 -58.76 2.34 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.678 -1.264 . . . . 0.0 111.956 163.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -55.11 -58.0 9.43 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.62 1.968 . . . . 0.0 115.845 -173.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.2 t90 -78.48 -27.22 46.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.191 -0.943 . . . . 0.0 110.453 -167.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -73.08 -35.68 66.68 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.049 -1.657 . . . . 0.0 112.256 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.76 -29.17 69.07 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.107 -0.996 . . . . 0.0 113.038 172.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.445 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.0 t90 -75.8 -52.95 9.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.162 1.385 . . . . 0.0 111.805 178.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -55.6 -29.46 59.16 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 131.091 3.756 . . . . 0.0 113.053 176.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -54.48 -40.7 68.72 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.785 1.234 . . . . 0.0 113.11 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.56 46.27 0.98 Allowed 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 122.639 1.209 . . . . 0.0 111.877 175.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.06 -47.13 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.436 1 N-CA-C 123.564 4.653 . . . . 0.0 123.564 167.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.87 -16.44 0.51 Allowed Glycine 0 N--CA 1.43 -1.757 0 CA-C-N 121.396 1.907 . . . . 0.0 113.113 -160.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.1 tptp -104.71 11.1 34.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.397 2.046 . . . . 0.0 110.289 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.2 m -46.11 -47.87 17.28 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 129.399 3.079 . . . . 0.0 116.188 -174.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -74.67 -16.94 60.75 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.369 -1.457 . . . . 0.0 114.133 -174.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -93.36 -38.72 11.32 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.688 1.595 . . . . 0.0 112.858 177.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -87.82 -40.24 14.19 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.778 -1.201 . . . . 0.0 111.251 -177.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.697 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -54.94 -58.54 7.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.813 1.412 . . . . 0.0 114.813 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -43.42 -27.69 0.29 Allowed 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 172.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -88.52 -39.56 14.08 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.707 2.003 . . . . 0.0 112.996 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -78.49 -21.74 48.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.594 -0.691 . . . . 0.0 111.571 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.428 ' CE2' HG21 ' A' ' 77' ' ' VAL . 16.7 t80 -68.28 -52.3 35.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.793 1.237 . . . . 0.0 112.09 -167.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 17.5 tt -40.28 -50.56 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.312 1.597 . . . . 0.0 115.312 166.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.33 -30.14 63.15 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.639 1.718 . . . . 0.0 115.639 -178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 69.7 mt -67.33 -53.51 28.9 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.872 -1.767 . . . . 0.0 111.577 170.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.5 HG13 HG11 ' A' ' 12' ' ' VAL . 24.3 t -74.53 -24.79 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 C-N-CA 125.566 1.546 . . . . 0.0 111.172 -167.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -65.65 -30.54 71.26 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.419 -2.05 . . . . 0.0 112.873 170.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -83.52 -13.38 54.69 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.63 -1.294 . . . . 0.0 113.058 175.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.7 mp -78.25 -63.35 1.42 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.168 -1.583 . . . . 0.0 108.068 163.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.478 HD13 HD21 ' A' ' 15' ' ' LEU . 6.2 mm -50.85 -39.79 19.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 128.55 2.74 . . . . 0.0 114.467 -174.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.15 -34.23 65.95 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 172.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 4.3 mppt? -87.53 -38.66 15.82 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.257 -1.527 . . . . 0.0 112.29 166.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' A' ' 15' ' ' LEU . 3.6 m-30 -91.83 -30.84 15.98 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.236 -1.54 . . . . 0.0 113.701 -156.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 24.0 p -35.01 -54.79 0.59 Allowed 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 118.383 2.734 . . . . 0.0 118.383 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 C--O 1.26 1.611 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 171.512 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.491 -1.31 0 N-CA-C 115.16 1.541 . . . . 0.0 115.16 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -75.21 -23.01 57.55 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.469 -2.019 . . . . 0.0 114.699 -170.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -85.58 -44.62 12.48 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.594 -1.316 . . . . 0.0 109.753 176.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 64.9 tp -52.06 -45.74 64.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.849 2.86 . . . . 0.0 110.692 178.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 19.3 t80 -43.28 -49.2 6.79 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 128.603 2.761 . . . . 0.0 111.091 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -80.17 -39.46 29.26 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 121.161 -0.962 . . . . 0.0 112.767 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -65.48 -40.08 92.71 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.483 -1.386 . . . . 0.0 113.268 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -82.41 -27.63 31.9 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.496 1.118 . . . . 0.0 112.633 177.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.409 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -63.48 -45.25 91.59 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.64 -1.912 . . . . 0.0 114.428 173.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -61.29 -26.72 67.97 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.332 1.453 . . . . 0.0 112.828 174.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.09 -59.07 2.93 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 123.813 0.845 . . . . 0.0 110.592 170.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 29.8 m -61.38 -31.21 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 O-C-N 120.487 -1.383 . . . . 0.0 113.589 -169.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -70.78 -21.11 62.54 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 176.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -127.2 22.97 6.53 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.864 1.266 . . . . 0.0 112.224 -175.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.5 mt -71.73 157.21 90.15 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 119.4 -2.063 . . . . 0.0 110.911 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -74.88 -24.13 13.4 Favored 'Trans proline' 0 C--N 1.299 -2.038 0 C-N-CA 123.166 2.578 . . . . 0.0 110.676 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.7 m -105.11 80.88 1.66 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 102.601 -3.111 . . . . 0.0 102.601 171.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -58.51 157.32 18.86 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 126.259 1.824 . . . . 0.0 114.356 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -68.31 149.02 75.23 Favored 'Trans proline' 0 C--N 1.299 -2.054 0 C-N-CA 122.869 2.379 . . . . 0.0 112.186 -171.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.7 t -71.38 145.07 49.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 120.022 1.283 . . . . 0.0 113.326 178.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 49.4 m -36.14 -59.95 0.58 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.138 3.375 . . . . 0.0 117.192 -168.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -84.36 -32.82 24.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.615 -1.303 . . . . 0.0 111.165 -173.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.41 -36.84 82.07 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.526 1.531 . . . . 0.0 111.032 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.5 tt -50.53 -31.26 15.06 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 127.029 2.131 . . . . 0.0 115.255 166.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.53 -38.88 74.29 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.965 -1.709 . . . . 0.0 113.177 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -65.47 -46.1 81.12 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.589 1.185 . . . . 0.0 111.359 173.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.23 -34.52 78.21 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.235 1.414 . . . . 0.0 113.138 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -56.93 -59.69 4.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.311 1.844 . . . . 0.0 111.184 167.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.95 -44.39 60.45 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.471 HD23 ' HA ' ' A' ' 69' ' ' ALA . 2.6 mp -66.91 -52.24 45.57 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 172.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.409 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 12.6 t80 -54.97 -52.28 63.55 Favored 'General case' 0 N--CA 1.431 -1.386 0 CA-C-O 124.054 1.883 . . . . 0.0 111.439 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.522 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 27.9 mmmt -61.58 -31.95 72.03 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.363 1.465 . . . . 0.0 113.016 172.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -63.52 -61.33 2.4 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.91 -1.743 . . . . 0.0 115.414 173.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE 0.305 . . -84.26 0.13 50.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 -179.372 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -74.68 -61.31 1.92 Allowed 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.748 -1.845 . . . . 0.0 112.185 155.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.418 HG11 ' HB2' ' A' ' 40' ' ' ASP . 46.9 t -77.68 -55.03 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.022 -1.674 . . . . 0.0 113.024 -172.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.97 -0.26 62.39 Favored Glycine 0 N--CA 1.432 -1.611 0 C-N-CA 127.132 2.301 . . . . 0.0 114.168 -177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -136.99 173.0 12.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 166.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HA ' ' CE2' ' A' ' 58' ' ' TRP . 35.3 p-10 -72.52 118.52 15.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.619 -1.301 . . . . 0.0 111.864 152.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' HB2' HG11 ' A' ' 36' ' ' VAL . 48.3 t0 -79.94 -81.04 0.12 Allowed 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.106 -1.621 . . . . 0.0 113.42 -168.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 mttm -87.96 92.42 9.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.548 1.139 . . . . 0.0 112.326 -162.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -78.01 49.45 0.8 Allowed 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 124.187 1.946 . . . . 0.0 112.827 -175.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 57.8 tttt -160.26 89.34 1.8 Allowed Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 127.026 2.13 . . . . 0.0 107.349 167.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.4 161.88 36.92 Favored 'Trans proline' 0 N--CA 1.433 -2.061 0 C-N-CA 122.454 2.103 . . . . 0.0 108.953 159.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -75.41 166.53 54.73 Favored Glycine 0 N--CA 1.43 -1.719 0 CA-C-N 120.797 1.635 . . . . 0.0 114.24 -166.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.0 pt -84.81 -36.93 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 120.649 -1.501 . . . . 0.0 111.346 -152.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -111.11 24.64 12.65 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.387 2.275 . . . . 0.0 109.537 169.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -84.44 97.9 9.77 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.561 -1.337 . . . . 0.0 111.924 -171.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -71.78 -11.44 60.82 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -174.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -92.32 -63.78 1.19 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.566 -1.334 . . . . 0.0 110.082 171.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -64.25 -30.44 71.49 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -165.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -55.63 -35.02 65.45 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 124.673 1.189 . . . . 0.0 114.11 175.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -82.26 -47.63 12.19 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.96 1.704 . . . . 0.0 110.658 -178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -57.34 -48.37 79.18 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.764 1.226 . . . . 0.0 112.688 179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -70.51 -30.91 67.8 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.118 -0.989 . . . . 0.0 113.509 -178.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -73.39 -34.95 65.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.685 -1.884 . . . . 0.0 112.002 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.63 -31.93 72.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.253 -1.529 . . . . 0.0 112.958 171.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.522 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 9.8 t90 -67.91 -37.39 81.64 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.771 1.228 . . . . 0.0 112.496 173.473 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.26 -24.28 67.18 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.121 2.168 . . . . 0.0 114.101 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -72.07 -20.97 61.58 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 118.752 -2.467 . . . . 0.0 113.04 171.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 18.0 mt -101.06 -0.57 36.11 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.527 1.131 . . . . 0.0 113.728 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.8 pttt -26.44 -25.1 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 2 N-CA-C 124.694 5.072 . . . . 0.0 124.694 -158.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -165.5 27.42 0.19 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 119.389 -2.069 . . . . 0.0 110.952 167.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -117.24 -52.68 2.49 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.173 0.987 . . . . 0.0 110.03 -174.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.4 m -82.91 36.12 0.49 Allowed 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -164.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -73.72 -28.96 61.98 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 127.055 2.142 . . . . 0.0 108.728 163.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.25 -43.35 78.05 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 129.396 3.079 . . . . 0.0 111.154 175.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -80.39 -39.72 27.88 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 118.48 -0.771 . . . . 0.0 111.978 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.471 ' HA ' HD23 ' A' ' 30' ' ' LEU . . . -42.59 -61.88 1.12 Allowed 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 174.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -46.47 -47.92 19.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 118.729 2.863 . . . . 0.0 118.729 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 40.8 mttp -88.2 -29.35 20.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.773 -1.83 . . . . 0.0 113.978 -170.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -89.87 -22.29 22.12 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.596 -1.315 . . . . 0.0 110.594 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.488 ' CE2' HG21 ' A' ' 77' ' ' VAL . 24.7 t80 -67.74 -48.37 66.62 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.8 tt -39.1 -51.86 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 167.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.44 -32.93 72.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.7 mt -65.1 -49.86 68.34 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.873 -1.142 . . . . 0.0 112.452 171.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.488 HG21 ' CE2' ' A' ' 73' ' ' TYR . 43.8 t -71.96 -21.37 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 C-N-CA 125.617 1.567 . . . . 0.0 111.151 -171.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -62.63 -43.56 98.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.703 -1.873 . . . . 0.0 114.014 163.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -72.01 -15.56 62.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.316 1.446 . . . . 0.0 113.734 177.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 7.2 mp -81.94 -65.21 1.04 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.351 1.86 . . . . 0.0 109.953 170.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.0 mt -65.94 -29.66 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.557 -1.339 . . . . 0.0 112.863 -165.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.22 -37.82 49.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.719 -1.238 . . . . 0.0 114.292 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -87.56 -39.57 15.0 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.699 1.199 . . . . 0.0 111.38 174.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -98.92 -13.84 19.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.641 1.719 . . . . 0.0 115.641 -156.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.49 -54.37 44.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.261 1.706 0 O-C-N 121.313 -0.867 . . . . 0.0 109.959 173.082 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 115.335 1.606 . . . . 0.0 115.335 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 p -59.23 -30.69 68.43 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 128.94 2.896 . . . . 0.0 114.438 179.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -58.2 -37.69 75.28 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 174.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.77 -50.77 65.51 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 123.455 1.597 . . . . 0.0 111.552 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.6 OUTLIER -49.6 -36.61 24.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.962 2.505 . . . . 0.0 111.2 172.355 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -81.39 -26.36 35.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.639 -1.288 . . . . 0.0 113.359 -178.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -64.71 -53.11 52.42 Favored 'General case' 0 N--CA 1.428 -1.529 0 O-C-N 119.829 -1.794 . . . . 0.0 111.43 166.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -68.05 -43.48 78.57 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.037 2.135 . . . . 0.0 112.861 -171.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.479 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.76 -46.18 69.45 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 124.203 1.954 . . . . 0.0 113.524 -171.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.5 mmtt -65.87 -16.63 64.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 113.54 -1.664 . . . . 0.0 113.325 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.75 -55.76 5.06 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.158 0.89 . . . . 0.0 111.44 165.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.559 HG11 HG13 ' A' ' 77' ' ' VAL . 28.4 m -65.28 -25.9 38.32 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 119.854 -1.779 . . . . 0.0 114.035 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -72.73 -10.89 60.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.449 1.277 . . . . 0.0 114.449 174.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -148.22 29.25 0.88 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.935 1.35 . . . . 0.0 112.996 -177.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.453 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.7 tp -73.52 165.15 55.63 Favored Pre-proline 0 N--CA 1.429 -1.505 0 O-C-N 119.965 -1.709 . . . . 0.0 108.802 172.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.453 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 60.7 Cg_endo -74.56 -28.96 9.55 Favored 'Trans proline' 0 N--CA 1.433 -2.079 0 CA-C-N 124.718 2.721 . . . . 0.0 110.919 178.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 86.6 m -103.0 78.77 1.68 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 104.024 -2.584 . . . . 0.0 104.024 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.2 mtmm -64.75 152.81 89.41 Favored Pre-proline 0 N--CA 1.43 -1.474 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -67.52 150.15 80.14 Favored 'Trans proline' 0 C--N 1.301 -1.964 0 C-N-CA 122.924 2.416 . . . . 0.0 114.009 -161.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.8 t -81.04 174.54 11.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 119.661 1.119 . . . . 0.0 113.86 -171.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 90.6 m -57.55 -55.82 29.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.123 1.769 . . . . 0.0 114.595 -170.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -67.84 -31.03 70.58 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.408 1.883 . . . . 0.0 113.005 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -71.7 -59.87 2.53 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.44 1.896 . . . . 0.0 110.451 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.5 tp -49.25 -27.08 3.41 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.794 2.438 . . . . 0.0 117.129 -177.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.2 mt -61.23 -58.36 8.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.507 -1.371 . . . . 0.0 114.307 167.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -74.6 -35.16 62.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.188 0.994 . . . . 0.0 112.275 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.54 -32.6 73.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.643 1.577 . . . . 0.0 112.268 176.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -60.71 -55.24 35.57 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.425 -1.422 . . . . 0.0 110.867 164.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.04 -54.23 26.5 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 124.632 1.173 . . . . 0.0 112.598 -175.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.3 mp -63.04 -41.09 99.42 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.301 1.963 . . . . 0.0 116.301 174.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.479 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 34.1 t80 -61.53 -53.4 56.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.828 -1.17 . . . . 0.0 112.153 176.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.0 mmmt -53.79 -41.66 67.48 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.465 -2.022 . . . . 0.0 112.647 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -54.98 -60.66 3.06 Favored 'General case' 0 N--CA 1.431 -1.377 0 C-N-CA 124.576 1.151 . . . . 0.0 113.689 178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -89.29 -6.84 56.43 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.058 -1.651 . . . . 0.0 112.986 -175.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.1 m -68.27 -67.38 0.47 Allowed 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.492 -1.38 . . . . 0.0 111.49 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.4 m -87.35 -27.33 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.822 -1.174 . . . . 0.0 113.898 -175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.16 -17.73 57.67 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.065 -1.647 . . . . 0.0 115.553 171.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 -135.14 166.59 22.73 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 179.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -56.45 85.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 151.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -77.52 -67.4 0.72 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.684 1.994 . . . . 0.0 113.475 -167.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 158.32 18.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 106.883 -1.525 . . . . 0.0 106.883 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.2 tt0 -131.96 17.16 4.65 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 124.791 2.234 . . . . 0.0 107.726 172.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -121.86 96.64 46.86 Favored Pre-proline 0 N--CA 1.431 -1.411 0 C-N-CA 125.855 1.662 . . . . 0.0 108.435 -179.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.0 -165.33 0.32 Allowed 'Trans proline' 0 C--N 1.3 -2.01 0 C-N-CA 122.744 2.296 . . . . 0.0 111.249 166.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -63.26 174.68 9.44 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 117.255 1.662 . . . . 0.0 117.255 -175.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 17.4 pt -86.66 -46.73 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.174 -1.78 . . . . 0.0 112.304 -167.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -85.47 -5.24 59.31 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.27 2.228 . . . . 0.0 111.848 177.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.298 0.1 OUTLIER -17.02 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 121.784 3.994 . . . . 0.0 121.784 -170.064 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.3 mtt -93.48 -54.92 3.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.7 -1.25 . . . . 0.0 107.785 163.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 33.9 mttm -72.47 -42.06 65.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.627 -1.296 . . . . 0.0 114.313 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -62.13 -34.37 76.23 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.408 1.633 . . . . 0.0 115.408 -178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.3 ptt180 -73.26 -18.01 61.27 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.983 -1.698 . . . . 0.0 114.446 -176.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -76.44 -50.1 14.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.106 -0.996 . . . . 0.0 111.131 166.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.89 -51.04 68.99 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.439 1.496 . . . . 0.0 114.248 177.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -66.26 -36.74 83.79 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.516 1.126 . . . . 0.0 112.681 -178.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -74.03 -32.38 63.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.522 -1.986 . . . . 0.0 112.434 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.87 -25.68 67.3 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.108 -1.62 . . . . 0.0 112.793 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -80.07 -49.34 11.9 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.964 2.506 . . . . 0.0 110.223 177.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -12.48 40.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.713 2.005 . . . . 0.0 114.181 -179.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -72.09 -21.58 61.48 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.625 -1.922 . . . . 0.0 113.846 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.2 mp -114.92 14.69 17.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.86 -1.15 . . . . 0.0 113.207 178.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.94 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 1 N-CA-C 122.997 4.443 . . . . 0.0 122.997 177.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -102.36 -47.83 1.38 Allowed Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 126.274 1.892 . . . . 0.0 112.366 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -86.96 -6.11 58.87 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.819 -1.401 . . . . 0.0 113.401 -170.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.8 m -28.04 -61.44 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 129.468 3.107 . . . . 0.0 118.47 -175.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.4 -14.56 63.03 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -92.52 -44.56 8.57 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.703 1.201 . . . . 0.0 110.239 177.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -36.15 12.62 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -167.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -59.17 -53.12 61.95 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -41.08 -39.64 1.29 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 119.352 3.093 . . . . 0.0 119.352 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.5 mttp -88.25 -34.96 17.56 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.824 -1.797 . . . . 0.0 113.835 -176.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -77.53 -29.41 52.31 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.84 -1.162 . . . . 0.0 110.972 176.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.405 ' CE2' HG21 ' A' ' 77' ' ' VAL . 43.4 t80 -66.83 -45.93 76.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.383 -1.448 . . . . 0.0 113.959 -173.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 5.5 tp -47.11 -45.83 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 174.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.05 -39.87 87.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 mt -64.35 -42.63 96.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.454 1.102 . . . . 0.0 113.099 174.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.559 HG13 HG11 ' A' ' 12' ' ' VAL . 49.8 t -77.32 -23.98 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.531 1.532 . . . . 0.0 111.096 -174.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -63.36 -42.35 98.89 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.32 -2.113 . . . . 0.0 112.068 168.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -65.51 -26.97 68.14 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.356 1.463 . . . . 0.0 113.855 173.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 mt -72.46 -63.1 1.22 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.219 1.408 . . . . 0.0 109.294 171.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.0 mt -64.45 -31.03 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.539 1.536 . . . . 0.0 113.185 -169.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -55.74 -30.01 60.5 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 170.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -87.65 -48.32 7.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.045 -1.035 . . . . 0.0 110.989 165.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-30 -95.0 -12.23 27.03 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 -149.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -46.31 -54.72 8.42 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.961 1.704 . . . . 0.0 114.523 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.26 1.614 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 166.303 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.322 12.1 m . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 116.179 1.918 . . . . 0.0 116.179 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -64.92 -23.38 67.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 122.326 2.33 . . . . 0.0 114.967 -171.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.9 mm-40 -77.88 -43.4 30.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.44 -1.413 . . . . 0.0 112.339 173.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.5 tp -60.36 -44.06 95.95 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.83 1.652 . . . . 0.0 110.725 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.471 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 16.2 t80 -44.06 -40.01 4.57 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 128.074 2.55 . . . . 0.0 112.496 174.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -74.92 -46.05 38.43 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.092 -1.005 . . . . 0.0 111.71 178.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -58.49 -40.21 82.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.365 1.079 . . . . 0.0 113.858 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HB3' HG11 ' A' ' 77' ' ' VAL . 27.6 mmtt -65.89 -50.71 63.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.023 2.529 . . . . 0.0 112.299 172.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.45 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -68.33 -49.89 57.14 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 124.274 1.988 . . . . 0.0 114.531 -167.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -65.99 -14.79 62.26 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 113.185 -1.825 . . . . 0.0 113.789 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.27 -60.36 2.33 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.73 -1.231 . . . . 0.0 110.668 161.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.554 HG11 HG13 ' A' ' 77' ' ' VAL . 24.0 m -65.83 -28.84 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 120.069 -1.645 . . . . 0.0 114.929 -168.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -75.93 -14.49 60.25 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.075 -1.016 . . . . 0.0 113.026 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -106.53 -32.78 7.92 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.589 1.955 . . . . 0.0 113.538 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.5 mt -46.32 154.95 0.59 Allowed Pre-proline 0 N--CA 1.43 -1.425 0 C-N-CA 129.787 3.235 . . . . 0.0 116.464 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -75.16 -14.95 20.64 Favored 'Trans proline' 0 C--N 1.299 -2.044 0 C-N-CA 122.847 2.365 . . . . 0.0 111.874 -174.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 56.1 m -111.79 76.3 0.97 Allowed 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.091 -2.929 . . . . 0.0 103.091 173.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -57.56 144.19 73.1 Favored Pre-proline 0 N--CA 1.431 -1.424 0 C-N-CA 124.444 1.098 . . . . 0.0 113.72 -178.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -65.31 140.63 65.0 Favored 'Trans proline' 0 N--CA 1.433 -2.058 0 C-N-CA 122.987 2.458 . . . . 0.0 112.811 -157.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 66.3 m -65.72 153.96 40.28 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 120.606 1.548 . . . . 0.0 113.804 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.4 m -40.93 -56.8 2.15 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 128.34 2.656 . . . . 0.0 116.805 -168.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -72.6 -33.38 66.67 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.926 1.69 . . . . 0.0 113.342 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -76.37 -46.78 25.89 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.714 1.606 . . . . 0.0 110.191 -175.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.1 tp -44.42 -38.22 3.9 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.251 2.221 . . . . 0.0 115.991 172.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.95 -42.59 57.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -176.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.28 -26.7 58.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.314 -1.491 . . . . 0.0 111.231 176.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -72.06 -37.79 69.58 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.591 -1.318 . . . . 0.0 112.865 171.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -54.15 -51.99 62.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.023 1.729 . . . . 0.0 111.83 168.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.96 -49.06 51.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mp -67.6 -46.79 71.58 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.45 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 35.0 t80 -54.69 -53.04 60.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.249 1.5 . . . . 0.0 111.186 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.428 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 24.9 mmmt -64.99 -29.94 70.9 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 118.77 -2.456 . . . . 0.0 112.805 176.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -64.03 -53.18 54.01 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.13 1.9 . . . . 0.0 116.13 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -86.29 -11.01 53.4 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.623 -1.923 . . . . 0.0 112.552 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 m -69.26 -53.77 18.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.485 -1.384 . . . . 0.0 112.179 166.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.455 HG12 ' H ' ' A' ' 38' ' ' ASP . 46.3 t -86.82 -62.05 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 O-C-N 120.631 -1.293 . . . . 0.0 112.708 -178.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 112.3 -26.62 10.96 Favored Glycine 0 N--CA 1.431 -1.666 0 C-N-CA 128.346 2.879 . . . . 0.0 112.153 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' H ' HG12 ' A' ' 36' ' ' VAL . 5.4 m-20 -119.09 -176.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 170.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -67.51 123.29 20.0 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.745 -1.847 . . . . 0.0 110.792 146.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -80.96 -62.15 1.75 Allowed 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.796 -1.815 . . . . 0.0 110.438 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -83.55 166.01 18.6 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -143.06 43.4 1.56 Allowed 'General case' 0 N--CA 1.43 -1.425 0 CA-C-O 124.08 1.895 . . . . 0.0 105.938 165.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -149.9 86.18 5.38 Favored Pre-proline 0 N--CA 1.429 -1.48 0 O-C-N 120.712 -1.243 . . . . 0.0 110.41 174.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -73.58 179.29 5.72 Favored 'Trans proline' 0 C--N 1.299 -2.029 0 C-N-CA 122.336 2.024 . . . . 0.0 109.548 155.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -76.92 -173.8 38.88 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.809 -1.807 . . . . 0.0 113.951 -173.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 24.4 pt -96.6 -50.42 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.962 -1.316 . . . . 0.0 108.954 -168.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -101.12 4.69 42.36 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.313 1.445 . . . . 0.0 110.674 168.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.51 83.28 3.2 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.878 -1.139 . . . . 0.0 112.516 178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 13.3 tpt -64.24 -38.74 92.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.259 -1.526 . . . . 0.0 112.748 -172.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -65.14 -49.47 69.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.322 1.449 . . . . 0.0 113.518 179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -62.13 -42.62 99.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.347 -1.471 . . . . 0.0 111.903 172.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 60.8 mtp85 -56.92 -46.9 81.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.323 1.971 . . . . 0.0 116.323 177.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . 0.298 8.3 p90 -71.5 -35.95 70.93 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 120.707 1.594 . . . . 0.0 114.408 178.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -62.77 -45.72 91.37 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.652 -1.28 . . . . 0.0 112.029 173.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 9.9 t90 -66.0 -31.28 72.09 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.574 1.15 . . . . 0.0 113.037 176.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -68.92 -34.42 75.35 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 119.702 -1.874 . . . . 0.0 111.926 176.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.5 -23.71 61.06 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.205 -1.56 . . . . 0.0 113.88 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.428 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 16.3 t90 -82.66 -43.88 16.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.124 1.37 . . . . 0.0 111.333 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -21.42 66.58 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.657 -1.277 . . . . 0.0 113.692 -178.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -56.24 -31.17 63.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.483 -1.386 . . . . 0.0 113.463 166.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.3 mt -105.7 -0.13 25.77 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.476 1.11 . . . . 0.0 113.913 -174.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -30.73 -16.2 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.411 2 N-CA-C 125.446 5.35 . . . . 0.0 125.446 -162.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -160.61 15.93 0.19 Allowed Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 122.04 2.2 . . . . 0.0 114.479 169.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -116.82 -52.18 2.55 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 119.545 1.673 . . . . 0.0 110.867 178.308 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.7 m -85.78 43.44 1.04 Allowed 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.528 1.307 . . . . 0.0 114.528 -161.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -73.15 -33.56 65.57 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.793 1.637 . . . . 0.0 107.648 155.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.09 -37.35 84.74 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.955 2.902 . . . . 0.0 110.809 178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -86.84 -45.68 10.65 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.018 1.327 . . . . 0.0 111.284 174.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -43.15 -61.39 1.33 Allowed 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -49.69 -37.4 28.7 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 119.525 3.158 . . . . 0.0 119.525 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -88.47 -31.43 18.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.502 -1.999 . . . . 0.0 114.99 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -83.62 -25.8 30.51 Favored 'General case' 0 N--CA 1.428 -1.55 0 O-C-N 121.165 -0.959 . . . . 0.0 110.404 179.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -66.25 -46.53 76.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -42.69 -52.75 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 170.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.69 -25.45 62.11 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.83 -51.83 24.18 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.787 -1.195 . . . . 0.0 110.983 170.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.599 HG11 ' HB3' ' A' ' 8' ' ' LYS . 77.9 t -70.62 -26.91 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.806 1.242 . . . . 0.0 111.597 -169.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -55.01 -42.13 72.17 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.475 -1.391 . . . . 0.0 113.379 167.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -78.77 -26.06 44.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.806 1.242 . . . . 0.0 114.135 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 6.7 mp -67.18 -56.37 10.18 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.386 1.474 . . . . 0.0 109.421 170.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -66.64 -31.21 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.829 -1.17 . . . . 0.0 112.479 -171.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -51.67 -34.44 38.27 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 168.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -86.9 -47.67 8.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.496 -1.377 . . . . 0.0 109.517 171.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-30 -93.58 -11.88 30.77 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -151.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -48.35 -54.48 13.74 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.485 1.661 . . . . 0.0 115.485 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 C--O 1.26 1.611 0 C-N-CA 123.556 0.742 . . . . 0.0 110.711 172.073 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 4' ' ' LEU . 2.4 p . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 122.209 1.004 . . . . 0.0 112.644 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -74.99 -26.52 59.62 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.997 2.119 . . . . 0.0 113.468 -171.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 -66.55 -49.15 67.39 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 118.988 -2.32 . . . . 0.0 112.911 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 1' ' ' VAL . 56.4 tp -60.17 -43.7 95.62 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.923 1.689 . . . . 0.0 111.82 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.545 ' CE1' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -44.14 -52.18 7.48 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.534 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -87.99 -28.74 21.24 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.145 -0.972 . . . . 0.0 111.2 -176.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -54.53 -46.46 73.57 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 119.461 1.028 . . . . 0.0 113.581 171.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -89.01 -20.39 24.47 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.476 -1.39 . . . . 0.0 114.352 173.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 119.237 -2.164 . . . . 0.0 113.071 175.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -64.84 -17.15 64.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.658 -1.156 . . . . 0.0 113.787 171.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.05 -60.07 2.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.467 -1.396 . . . . 0.0 110.032 167.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.431 HG11 HG13 ' A' ' 77' ' ' VAL . 35.5 m -62.57 -29.56 47.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 O-C-N 120.491 -1.381 . . . . 0.0 113.798 -169.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -82.19 -1.42 49.02 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.765 -1.209 . . . . 0.0 113.608 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -129.42 5.93 5.23 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.985 1.714 . . . . 0.0 112.87 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.423 HD11 HD13 ' A' ' 81' ' ' ILE . 14.2 mt -69.56 159.68 82.65 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 118.421 -2.674 . . . . 0.0 113.168 -175.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.62 -22.05 9.49 Favored 'Trans proline' 0 N--CA 1.434 -2.028 0 C-N-CA 122.82 2.347 . . . . 0.0 111.188 175.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -101.65 81.96 2.22 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 103.512 -2.773 . . . . 0.0 103.512 174.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 61.1 mttm -64.92 155.88 81.83 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 -172.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 66.7 Cg_exo -67.93 153.05 76.31 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 C-N-CA 122.023 1.815 . . . . 0.0 114.872 -163.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.8 m -82.15 145.16 30.26 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 84.4 m -53.41 -51.45 62.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.439 2.755 . . . . 0.0 118.439 -166.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -80.32 -12.84 59.56 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.867 -1.77 . . . . 0.0 113.881 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -85.38 -45.95 11.4 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.204 1.001 . . . . 0.0 109.699 171.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 23.8 tp -44.28 -38.41 3.84 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.775 2.83 . . . . 0.0 117.407 176.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.8 mt -49.97 -55.69 13.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 168.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -80.59 -31.11 36.83 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 123.924 0.89 . . . . 0.0 112.788 -177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.52 -31.74 70.16 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.961 -1.712 . . . . 0.0 112.673 174.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -58.5 -56.94 15.68 Favored 'General case' 0 N--CA 1.431 -1.378 0 O-C-N 120.317 -1.489 . . . . 0.0 110.151 161.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.91 -54.89 13.53 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.25 1.42 . . . . 0.0 113.613 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mp -65.07 -37.08 86.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.464 2.024 . . . . 0.0 116.464 176.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.428 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 27.1 t80 -60.99 -53.39 57.86 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.625 1.203 . . . . 0.0 111.066 176.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.408 ' HB3' ' CZ2' ' A' ' 58' ' ' TRP . 26.6 mmmt -54.96 -40.75 70.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 127.212 2.205 . . . . 0.0 113.426 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -57.92 -61.08 2.79 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.784 -1.197 . . . . 0.0 113.112 179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.545 ' HB3' ' CE1' ' A' ' 5' ' ' PHE . . . -82.43 -8.3 59.62 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . 0.257 1.3 p -68.19 -55.79 11.04 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.875 2.125 . . . . 0.0 111.722 165.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.5 p -87.23 -69.38 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 120.435 -1.415 . . . . 0.0 113.153 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 118.98 9.77 8.68 Favored Glycine 0 N--CA 1.431 -1.697 0 O-C-N 120.699 -1.25 . . . . 0.0 114.927 -173.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -140.27 164.89 28.88 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 169.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -70.84 83.3 0.65 Allowed 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.512 -1.367 . . . . 0.0 111.643 149.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -82.1 -54.53 5.21 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.733 -1.854 . . . . 0.0 114.393 -158.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -84.79 82.32 8.49 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.519 -1.363 . . . . 0.0 114.643 -171.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -81.3 46.5 0.94 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.759 -1.838 . . . . 0.0 114.469 -172.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -160.01 91.0 1.78 Allowed Pre-proline 0 N--CA 1.43 -1.436 0 C-N-CA 126.911 2.084 . . . . 0.0 107.361 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.93 166.95 28.04 Favored 'Trans proline' 0 C--N 1.3 -2.025 0 C-N-CA 122.453 2.102 . . . . 0.0 112.787 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.9 -159.95 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.762 1 N-CA-C 123.346 4.098 . . . . 0.0 123.346 -153.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 20.3 pt -90.57 -43.86 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 O-C-N 120.05 -1.853 . . . . 0.0 113.271 -156.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -88.39 -24.48 23.06 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.67 1.988 . . . . 0.0 110.741 174.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . 0.401 0.1 OUTLIER 5.79 87.12 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 131.507 3.923 . . . . 0.0 121.161 -173.694 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 60.7 mtt -98.98 -59.74 1.67 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 167.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -84.27 -29.35 26.51 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.302 1.441 . . . . 0.0 113.32 -172.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.28 -23.05 66.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.673 1.989 . . . . 0.0 114.074 -173.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.3 mtt-85 -55.81 -40.15 72.33 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.873 2.069 . . . . 0.0 113.363 170.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -90.5 -33.76 15.82 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.695 1.598 . . . . 0.0 110.947 -174.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -51.63 -51.9 52.06 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 125.624 1.57 . . . . 0.0 112.717 164.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -31.86 70.65 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.874 -1.142 . . . . 0.0 113.568 -179.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -67.44 -36.13 80.61 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.001 -1.687 . . . . 0.0 112.304 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.7 -28.15 66.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.544 1.137 . . . . 0.0 112.448 176.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.408 ' CZ2' ' HB3' ' A' ' 32' ' ' LYS . 10.1 t90 -79.65 -43.67 22.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 126.608 1.963 . . . . 0.0 110.57 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.37 -31.46 63.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.882 2.073 . . . . 0.0 113.802 175.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -52.34 -35.32 50.7 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.694 -1.879 . . . . 0.0 114.198 170.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 7.6 mp -113.73 31.9 6.2 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.968 0.89 . . . . 0.0 113.368 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.6 pttt -26.15 -50.58 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.463 1 N-CA-C 122.321 4.193 . . . . 0.0 122.321 172.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -128.29 -17.46 1.98 Allowed Glycine 0 N--CA 1.43 -1.715 0 CA-C-N 119.469 1.032 . . . . 0.0 114.871 -168.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 pttt -96.41 -5.07 40.62 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 119.273 1.537 . . . . 0.0 111.459 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.3 p -26.71 -70.48 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 131.103 3.761 . . . . 0.0 117.219 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -53.84 -38.3 64.5 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.776 1.769 . . . . 0.0 115.776 -166.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -92.35 -21.03 20.48 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.087 1.355 . . . . 0.0 112.931 -177.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.48 -39.07 12.16 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.477 -2.015 . . . . 0.0 110.195 177.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.524 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -46.87 -62.03 1.58 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.674 1.989 . . . . 0.0 113.482 173.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.19 -33.99 21.19 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 119.283 3.068 . . . . 0.0 119.283 177.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -88.55 -28.69 20.59 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.217 1.807 . . . . 0.0 114.422 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -88.44 -26.86 21.89 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.899 -1.751 . . . . 0.0 111.99 174.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.486 ' CE2' HG21 ' A' ' 77' ' ' VAL . 28.0 t80 -66.74 -46.72 74.54 Favored 'General case' 0 N--CA 1.428 -1.528 0 O-C-N 120.173 -1.58 . . . . 0.0 112.388 -174.227 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 12.3 tt -39.12 -51.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 166.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.21 -26.5 59.01 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -174.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.2 mt -75.96 -53.08 8.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.017 -1.052 . . . . 0.0 110.313 170.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.486 HG21 ' CE2' ' A' ' 73' ' ' TYR . 41.9 t -68.46 -22.23 26.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.52 1.928 . . . . 0.0 111.168 -171.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -64.01 -35.25 80.1 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.58 -1.95 . . . . 0.0 113.683 169.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -83.66 -16.29 45.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.344 1.458 . . . . 0.0 112.666 178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.3 mp -73.23 -65.01 0.86 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.645 -1.285 . . . . 0.0 108.325 163.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 15' ' ' LEU . 3.9 mm -57.07 -40.86 75.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.639 1.976 . . . . 0.0 113.969 -170.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.37 -30.5 66.83 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 81.0 mttt -86.93 -44.7 11.44 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 121.043 -1.036 . . . . 0.0 109.07 170.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 19.1 m-30 -94.86 -26.63 16.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -152.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.5 t -40.92 -54.69 2.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.613 1.965 . . . . 0.0 115.88 -175.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.261 1.704 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 166.534 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 84.8 t . . . . . 0 CA--C 1.49 -1.329 0 CA-C-O 122.364 1.078 . . . . 0.0 113.449 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.0 m -86.53 0.87 53.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 130.564 3.545 . . . . 0.0 114.819 -174.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -67.4 -56.29 10.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.307 -2.12 . . . . 0.0 111.585 177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.616 HD23 ' H ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -62.0 -27.95 69.23 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 128.14 2.576 . . . . 0.0 112.558 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 39.7 t80 -56.97 -55.43 34.75 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.564 1.146 . . . . 0.0 110.789 169.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -79.15 -14.09 59.32 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 119.713 -1.867 . . . . 0.0 113.446 -178.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -66.07 -63.08 1.16 Allowed 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.533 1.635 . . . . 0.0 111.09 167.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -89.4 -17.0 29.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 113.944 -1.48 . . . . 0.0 113.924 -166.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -71.3 -39.8 71.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 121.095 1.77 . . . . 0.0 112.143 -179.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -40.08 63.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.756 2.022 . . . . 0.0 112.615 170.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.7 -56.64 5.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.614 1.165 . . . . 0.0 110.844 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.458 HG21 HD21 ' A' ' 27' ' ' LEU . 27.4 m -62.71 -27.22 42.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.263 -1.523 . . . . 0.0 114.347 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -69.94 -22.09 63.21 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 176.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -132.59 18.4 4.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.053 -1.029 . . . . 0.0 113.122 -174.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.466 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.6 tp -71.76 156.62 90.94 Favored Pre-proline 0 N--CA 1.431 -1.421 0 O-C-N 120.12 -1.612 . . . . 0.0 109.614 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.466 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 94.5 Cg_endo -76.03 -20.58 14.77 Favored 'Trans proline' 0 C--N 1.299 -2.047 0 CA-C-N 123.356 2.234 . . . . 0.0 111.1 -174.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 50.8 m -106.03 76.49 1.17 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 103.195 -2.891 . . . . 0.0 103.195 177.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -62.09 150.62 83.25 Favored Pre-proline 0 N--CA 1.43 -1.445 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -172.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -66.3 150.8 84.48 Favored 'Trans proline' 0 N--CA 1.434 -1.99 0 C-N-CA 123.512 2.808 . . . . 0.0 113.187 -163.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -82.78 171.03 14.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 120.401 1.455 . . . . 0.0 113.944 -171.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.4 m -47.82 -57.9 5.04 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 129.999 3.32 . . . . 0.0 117.039 -168.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -83.77 -22.81 31.77 Favored 'General case' 0 CA--C 1.489 -1.376 0 O-C-N 120.784 -1.197 . . . . 0.0 112.449 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -69.76 -40.77 75.9 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.401 1.481 . . . . 0.0 110.491 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.2 -53.22 5.2 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.283 3.033 . . . . 0.0 114.575 175.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -54.03 -46.92 72.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.267 2.227 . . . . 0.0 115.248 176.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.03 -44.27 76.84 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.516 -1.365 . . . . 0.0 111.918 172.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.458 HD21 HG21 ' A' ' 12' ' ' VAL . 2.1 tm? -62.9 -45.37 92.82 Favored 'General case' 0 N--CA 1.431 -1.38 0 C-N-CA 127.406 2.283 . . . . 0.0 113.59 -174.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -59.32 -57.12 14.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.832 2.053 . . . . 0.0 110.575 167.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.86 -46.74 71.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.297 1.039 . . . . 0.0 113.742 -172.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.1 mp -72.95 -39.82 65.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.557 1.688 . . . . 0.0 115.557 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.566 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 17.4 t80 -57.62 -55.13 38.86 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.783 1.278 . . . . 0.0 110.839 176.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -60.14 -31.48 70.12 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.216 -1.553 . . . . 0.0 113.654 172.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.42 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 22.3 mt-30 -57.99 -61.64 2.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.05 -1.656 . . . . 0.0 115.349 174.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.48 -9.83 48.61 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 119.184 -1.007 . . . . 0.0 112.771 -174.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 97.2 m -71.42 -52.38 18.87 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.715 -1.241 . . . . 0.0 111.211 168.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.422 HG11 ' CB ' ' A' ' 40' ' ' ASP . 2.0 t -84.94 -54.06 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 120.178 -1.576 . . . . 0.0 111.34 -178.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.58 -20.32 8.86 Favored Glycine 0 N--CA 1.429 -1.802 0 O-C-N 121.016 -1.052 . . . . 0.0 115.162 168.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -135.37 175.62 9.42 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 104.267 -2.494 . . . . 0.0 104.267 166.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -66.36 97.79 0.43 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.692 -1.255 . . . . 0.0 113.377 161.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.422 ' CB ' HG11 ' A' ' 36' ' ' VAL . 7.7 t70 -85.32 -65.71 0.98 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 119.666 -1.896 . . . . 0.0 114.42 -166.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.0 mtmt -85.19 81.86 8.64 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.214 -1.554 . . . . 0.0 115.108 -164.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -78.76 48.31 0.81 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 123.874 1.797 . . . . 0.0 113.3 -174.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.8 pttt -160.22 87.35 1.9 Allowed Pre-proline 0 N--CA 1.43 -1.439 0 C-N-CA 128.198 2.599 . . . . 0.0 110.037 175.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.35 -177.74 3.21 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 123.283 2.656 . . . . 0.0 111.598 164.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -74.46 -175.11 33.38 Favored Glycine 0 N--CA 1.429 -1.785 0 CA-C-N 120.836 1.653 . . . . 0.0 117.041 -161.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 9.0 pt -94.4 -34.85 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 O-C-N 120.906 -1.349 . . . . 0.0 110.196 -163.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 4.5 p90 -117.18 5.07 12.67 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.692 1.197 . . . . 0.0 109.839 169.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -81.04 103.6 10.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -163.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 64.1 mtm -73.96 -40.28 63.13 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.69 -1.256 . . . . 0.0 111.502 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -68.11 -50.83 52.4 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.984 1.314 . . . . 0.0 113.543 -175.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -60.73 -35.33 76.09 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.674 -1.266 . . . . 0.0 113.745 175.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -57.6 -44.66 85.61 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.304 -1.497 . . . . 0.0 114.789 171.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -64.39 -49.68 70.66 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.513 -1.367 . . . . 0.0 112.092 174.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -56.17 -43.4 78.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 125.024 1.33 . . . . 0.0 114.077 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -68.29 -36.84 79.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -71.85 -27.19 62.72 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.742 -1.849 . . . . 0.0 112.26 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -72.03 -24.49 61.56 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.93 -1.731 . . . . 0.0 113.563 170.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.42 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 13.4 t90 -81.48 -47.87 12.59 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.208 1.803 . . . . 0.0 110.586 179.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.54 -10.28 50.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.196 1.799 . . . . 0.0 114.948 -178.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -62.5 -40.57 97.16 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.182 -0.949 . . . . 0.0 111.919 164.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.8 mp -108.69 41.11 1.65 Allowed 'General case' 0 N--CA 1.429 -1.505 0 CA-C-O 123.922 1.82 . . . . 0.0 110.292 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -27.03 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.51 1 N-CA-C 122.117 4.117 . . . . 0.0 122.117 166.281 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.87 -18.41 0.86 Allowed Glycine 0 N--CA 1.43 -1.711 0 CA-C-N 120.351 1.432 . . . . 0.0 114.23 -158.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.1 mttm -107.74 26.13 10.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 124.552 2.12 . . . . 0.0 111.162 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.9 m -55.13 -50.7 68.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 129.259 3.024 . . . . 0.0 115.59 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -78.11 -10.88 59.83 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.999 -1.688 . . . . 0.0 114.458 -175.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -91.14 -45.24 8.78 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 123.367 0.667 . . . . 0.0 110.63 172.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -92.69 -35.37 13.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 -169.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.95 -61.98 1.96 Allowed 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 121.061 -1.024 . . . . 0.0 112.882 176.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -40.68 -40.52 1.31 Allowed 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 119.662 3.208 . . . . 0.0 119.662 176.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -87.38 -36.2 17.91 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.638 -1.914 . . . . 0.0 114.227 -175.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -82.5 -21.8 35.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.495 -1.378 . . . . 0.0 110.853 175.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.451 ' CE2' HG21 ' A' ' 77' ' ' VAL . 16.2 t80 -63.9 -52.36 60.28 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.853 -1.154 . . . . 0.0 113.98 -177.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' HB ' HD12 ' A' ' 4' ' ' LEU . 0.0 OUTLIER -39.88 -50.25 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 169.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.91 -15.3 60.21 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.926 1.825 . . . . 0.0 115.926 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 87.3 mt -75.09 -59.27 2.81 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 120.052 -1.655 . . . . 0.0 110.317 164.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.451 HG21 ' CE2' ' A' ' 73' ' ' TYR . 22.6 t -73.27 -28.99 26.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 127.25 2.22 . . . . 0.0 111.601 -164.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -63.99 -37.59 87.98 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.853 -1.779 . . . . 0.0 112.301 175.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -82.62 -12.67 57.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.787 1.235 . . . . 0.0 112.805 178.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 18.8 mt -73.98 -61.75 1.74 Allowed 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.121 1.368 . . . . 0.0 108.919 162.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.7 mm -53.87 -38.94 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 128.705 2.802 . . . . 0.0 114.288 -177.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -48.77 -43.55 37.97 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.093 1.357 . . . . 0.0 114.082 171.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mttp -86.56 -39.5 16.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.074 -1.016 . . . . 0.0 110.353 176.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -100.6 -20.38 15.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -155.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.6 t -43.05 -55.08 4.0 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.709 1.604 . . . . 0.0 115.125 177.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 C--O 1.261 1.672 0 O-C-N 121.595 -0.691 . . . . 0.0 109.439 168.807 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 t . . . . . 0 CA--C 1.49 -1.334 0 CA-C-O 122.199 1.0 . . . . 0.0 112.903 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -71.09 -19.06 62.51 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.144 -2.222 . . . . 0.0 114.296 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -71.9 -34.93 69.54 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.477 -2.014 . . . . 0.0 112.393 177.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 tp -62.95 -46.5 87.44 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.703 1.601 . . . . 0.0 111.651 173.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.504 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 8.9 t80 -48.09 -48.14 33.8 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.198 1.799 . . . . 0.0 111.451 179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -76.16 -38.24 56.91 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.37 -0.831 . . . . 0.0 112.168 -175.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.52 -51.44 62.83 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.59 1.556 . . . . 0.0 113.21 173.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -86.5 -25.31 25.18 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 120.525 -1.36 . . . . 0.0 114.629 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.489 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -62.73 -47.13 84.9 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 121.603 2.001 . . . . 0.0 113.619 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -64.99 -19.6 66.08 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.251 1.42 . . . . 0.0 114.548 174.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.78 -59.05 2.91 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.749 -1.219 . . . . 0.0 110.633 168.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 34.6 m -63.22 -28.56 45.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.69 1.596 . . . . 0.0 113.062 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -70.11 -19.69 63.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 175.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -134.64 30.76 3.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 CA-C-N 120.12 1.327 . . . . 0.0 112.322 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.9 mt -68.12 155.91 91.02 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 119.613 -1.929 . . . . 0.0 112.067 173.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -76.72 -19.53 14.31 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 C-N-CA 123.538 2.826 . . . . 0.0 111.633 -172.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.1 m -109.81 76.09 0.97 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 101.712 -3.44 . . . . 0.0 101.712 175.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -55.7 156.82 8.52 Favored Pre-proline 0 N--CA 1.43 -1.447 0 C-N-CA 127.264 2.225 . . . . 0.0 116.455 -169.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -56.4 136.62 76.6 Favored 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 124.095 3.197 . . . . 0.0 115.895 -172.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.9 m -79.44 139.05 37.79 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.658 1.183 . . . . 0.0 111.556 -176.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.9 m -44.4 -47.97 9.81 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.37 2.668 . . . . 0.0 117.907 -167.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -83.55 -27.39 29.34 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.552 -1.343 . . . . 0.0 114.27 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.69 -35.07 58.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.653 1.581 . . . . 0.0 110.581 179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -52.05 -35.33 46.97 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 129.202 3.001 . . . . 0.0 113.524 173.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.8 mt -64.03 -47.16 81.33 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.699 1.6 . . . . 0.0 114.298 176.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.17 -45.12 89.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 122.599 1.19 . . . . 0.0 112.458 173.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.84 -45.19 93.2 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.585 2.354 . . . . 0.0 112.606 178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -48.59 -56.96 6.98 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.777 2.431 . . . . 0.0 112.318 168.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.3 -48.16 62.39 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 0.0 114.1 -175.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.463 HD12 ' HA ' ' A' ' 69' ' ' ALA . 3.7 mm? -77.13 -39.5 49.06 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.732 1.012 . . . . 0.0 113.732 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.489 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 18.9 t80 -58.19 -56.64 19.42 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.767 1.627 . . . . 0.0 111.748 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -60.32 -35.94 76.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.331 -1.48 . . . . 0.0 112.779 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.456 ' HA ' ' HE1' ' A' ' 58' ' ' TRP . 2.6 mt-30 -50.39 -62.2 1.73 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 174.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.504 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -89.06 -9.92 49.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 120.568 1.531 . . . . 0.0 113.042 -178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.7 m -60.93 -67.83 0.37 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 0.0 112.918 167.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . 0.265 11.8 m -87.78 -32.6 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.123 -1.611 . . . . 0.0 114.53 -179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 113.03 -37.25 3.71 Favored Glycine 0 N--CA 1.431 -1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 115.984 171.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -118.43 171.24 8.29 Favored 'General case' 0 N--CA 1.429 -1.504 0 CA-C-N 118.992 1.396 . . . . 0.0 108.279 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -66.44 87.76 0.12 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.149 -1.595 . . . . 0.0 113.278 155.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -80.68 -59.09 2.81 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.374 -2.079 . . . . 0.0 114.994 -161.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.06 83.45 7.76 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.029 -1.67 . . . . 0.0 113.087 -171.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -72.45 42.68 0.1 Allowed 'General case' 0 N--CA 1.431 -1.421 0 CA-C-O 124.266 1.984 . . . . 0.0 114.001 178.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -160.02 84.89 2.1 Favored Pre-proline 0 N--CA 1.43 -1.457 0 C-N-CA 127.168 2.187 . . . . 0.0 108.597 174.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -71.06 165.76 31.36 Favored 'Trans proline' 0 N--CA 1.434 -1.996 0 C-N-CA 122.586 2.191 . . . . 0.0 109.146 151.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.56 -162.92 18.69 Favored Glycine 0 N--CA 1.431 -1.684 0 CA-C-N 120.802 1.637 . . . . 0.0 115.699 -174.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 27.4 pt -99.31 -54.1 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 O-C-N 120.632 -1.51 . . . . 0.0 111.72 -162.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -90.96 7.25 41.17 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 126.921 2.088 . . . . 0.0 110.581 172.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -80.34 73.15 7.23 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.447 1.899 . . . . 0.0 113.837 -169.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.0 mmt -54.67 -48.26 72.58 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.141 1.776 . . . . 0.0 114.368 -177.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 48.6 mttp -58.91 -47.51 84.74 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.431 1.092 . . . . 0.0 113.24 176.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -66.56 -37.36 84.8 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.955 -1.091 . . . . 0.0 113.521 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.0 mmm180 -56.24 -41.01 75.04 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.564 -1.335 . . . . 0.0 114.44 171.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -73.47 -45.99 50.85 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.692 -1.255 . . . . 0.0 113.244 175.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -55.78 -50.63 69.94 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.931 1.292 . . . . 0.0 114.069 175.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -71.17 -29.32 65.05 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.628 -1.295 . . . . 0.0 113.241 -177.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.93 -38.12 69.9 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.831 -1.793 . . . . 0.0 112.568 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.83 -24.75 66.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.896 -1.128 . . . . 0.0 112.369 175.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.456 ' HE1' ' HA ' ' A' ' 33' ' ' GLN . 11.2 t90 -82.17 -46.27 14.0 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.279 1.831 . . . . 0.0 110.86 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -57.24 -24.13 52.66 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.65 2.38 . . . . 0.0 113.764 174.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -50.4 -41.64 52.42 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.422 -2.049 . . . . 0.0 112.78 168.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 10.2 mp -116.96 42.77 2.43 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-O 123.534 1.635 . . . . 0.0 112.189 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.7 pttt -43.82 -41.54 5.09 Favored 'General case' 0 N--CA 1.431 -1.414 1 N-CA-C 122.263 4.171 . . . . 0.0 122.263 172.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -114.64 -40.77 0.9 Allowed Glycine 0 N--CA 1.431 -1.658 0 C-N-CA 123.652 0.644 . . . . 0.0 112.648 -169.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.0 mtmm -110.87 72.56 0.79 Allowed 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 124.999 2.333 . . . . 0.0 108.144 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 12.5 t -86.81 -65.29 1.03 Allowed 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 111.124 -2.762 . . . . 0.0 111.427 178.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -74.6 -10.8 59.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -151.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -92.9 -26.5 17.59 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.029 2.132 . . . . 0.0 113.922 170.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.37 -47.85 6.69 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.926 -1.733 . . . . 0.0 110.851 178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HA ' HD12 ' A' ' 30' ' ' LEU . . . -43.1 -59.58 1.99 Allowed 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.322 2.649 . . . . 0.0 113.682 -175.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -40.85 -48.39 3.08 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 118.802 2.89 . . . . 0.0 118.802 168.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -88.41 -29.5 20.18 Favored 'General case' 0 N--CA 1.429 -1.52 0 O-C-N 119.607 -1.933 . . . . 0.0 112.531 -173.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -71.92 -29.97 64.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.574 -1.328 . . . . 0.0 111.862 172.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -70.85 -53.68 14.35 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.935 1.294 . . . . 0.0 113.512 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.99 -50.15 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 N-CA-C 115.626 1.713 . . . . 0.0 115.626 173.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.33 -36.67 68.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -175.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.5 pp -75.12 -46.16 36.28 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.22 -0.925 . . . . 0.0 112.607 175.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 t -62.19 -30.08 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.238 1.815 . . . . 0.0 111.347 178.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -58.75 -42.18 88.25 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.882 -1.761 . . . . 0.0 112.715 172.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -74.84 -27.78 60.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.683 1.193 . . . . 0.0 113.077 177.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 44.7 mt -68.58 -52.3 33.13 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.321 1.448 . . . . 0.0 110.298 173.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.67 -32.29 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 119.939 -1.725 . . . . 0.0 113.512 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -56.8 -32.47 65.72 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.176 -1.577 . . . . 0.0 114.765 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -87.41 -38.94 15.69 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.776 -1.202 . . . . 0.0 111.891 171.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -95.58 -7.36 38.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.812 1.782 . . . . 0.0 115.812 -163.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 15.0 t -54.26 -60.42 3.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.188 -1.57 . . . . 0.0 113.372 166.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 C--O 1.259 1.564 0 C-N-CA 124.249 1.02 . . . . 0.0 108.979 168.688 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 123.044 1.402 . . . . 0.0 114.016 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 t -63.74 -29.77 70.95 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.045 2.538 . . . . 0.0 112.622 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -59.65 -43.52 93.86 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.784 -2.447 . . . . 0.0 115.474 177.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 41.8 tp -64.42 -42.71 95.9 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.463 -1.398 . . . . 0.0 111.09 176.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.554 ' CE2' ' HB3' ' A' ' 34' ' ' ALA . 0.1 OUTLIER -51.02 -38.6 52.37 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.39 1.876 . . . . 0.0 111.367 176.667 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.43 -47.82 38.63 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.042 -1.036 . . . . 0.0 112.606 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -54.96 -41.44 71.13 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.949 1.7 . . . . 0.0 112.868 177.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.519 ' HB3' HG11 ' A' ' 77' ' ' VAL . 29.0 mmtt -76.99 -45.34 27.71 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.661 1.184 . . . . 0.0 113.76 173.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.493 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -69.95 -41.23 74.81 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.103 -2.248 . . . . 0.0 114.839 -167.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -65.97 -15.74 63.27 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.671 1.188 . . . . 0.0 113.259 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.5 -56.69 4.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.712 1.205 . . . . 0.0 111.755 163.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 77' ' ' VAL . 6.9 m -63.08 -24.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 119.745 -1.847 . . . . 0.0 113.597 -170.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -70.14 -18.76 63.23 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 173.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -123.9 9.29 8.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -177.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.7 mt -63.15 146.72 95.66 Favored Pre-proline 0 N--CA 1.431 -1.416 0 O-C-N 120.62 -1.3 . . . . 0.0 113.301 -171.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -75.77 -20.57 15.26 Favored 'Trans proline' 0 N--CA 1.434 -1.994 0 C-N-CA 123.506 2.804 . . . . 0.0 111.312 -168.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 53.7 m -113.41 75.27 0.91 Allowed 'General case' 0 N--CA 1.43 -1.472 1 N-CA-C 99.609 -4.219 . . . . 0.0 99.609 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -56.75 156.92 11.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 117.206 2.299 . . . . 0.0 117.206 -164.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -59.68 134.52 58.12 Favored 'Trans proline' 0 N--CA 1.434 -1.992 0 C-N-CA 123.621 2.881 . . . . 0.0 113.892 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.8 t -80.97 166.4 20.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-N 119.729 1.149 . . . . 0.0 112.843 -176.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -51.59 -59.44 4.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 128.237 2.615 . . . . 0.0 117.343 -163.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -70.61 -26.97 63.74 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.913 -1.117 . . . . 0.0 112.548 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -77.87 -41.3 37.28 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.501 -1.374 . . . . 0.0 111.716 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 33.1 tp -46.64 -46.37 19.77 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 128.928 2.891 . . . . 0.0 115.544 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 54' ' ' LYS . 78.3 mt -48.04 -55.98 8.84 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.503 1.921 . . . . 0.0 114.922 170.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -72.95 -38.37 66.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.521 1.128 . . . . 0.0 112.178 -177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.462 HD11 HD22 ' A' ' 80' ' ' LEU . 6.7 mp -66.85 -36.06 81.47 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.538 1.135 . . . . 0.0 112.707 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -60.31 -57.96 10.57 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.343 1.457 . . . . 0.0 110.764 165.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.59 -52.97 26.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.183 1.393 . . . . 0.0 113.597 -173.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.9 mp -67.21 -40.55 86.45 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.514 1.672 . . . . 0.0 115.514 175.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.493 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 29.1 t80 -57.06 -52.94 63.27 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.735 1.255 . . . . 0.0 110.933 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.413 ' HB3' ' CE2' ' A' ' 58' ' ' TRP . 25.2 mmmt -57.81 -38.6 75.84 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.005 -2.309 . . . . 0.0 113.346 172.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -56.1 -57.71 11.03 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.554 ' HB3' ' CE2' ' A' ' 5' ' ' PHE . . . -89.44 -10.56 45.98 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 112.881 -175.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 55.1 m -64.48 -59.51 4.24 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.505 -1.372 . . . . 0.0 110.665 167.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.3 p -87.5 -60.97 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 O-C-N 120.821 -1.174 . . . . 0.0 112.784 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 122.79 -25.65 6.43 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 124.439 1.019 . . . . 0.0 113.544 -177.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -120.29 -177.85 3.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -66.9 124.7 23.7 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 118.768 -2.458 . . . . 0.0 112.915 147.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -84.09 -59.74 2.31 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.222 -1.549 . . . . 0.0 109.97 176.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 mtmm -80.19 161.4 25.24 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.46 1.504 . . . . 0.0 109.132 174.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 55' ' ' TRP . 21.8 tt0 -141.98 20.27 2.12 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.029 1.871 . . . . 0.0 109.733 168.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 56.1 tttp -129.53 91.53 40.71 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.198 -1.564 . . . . 0.0 110.644 177.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -77.94 159.37 30.86 Favored 'Trans proline' 0 C--N 1.299 -2.051 0 C-N-CA 121.716 1.611 . . . . 0.0 108.534 146.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.32 -145.89 2.28 Favored Glycine 0 N--CA 1.43 -1.712 0 N-CA-C 117.472 1.749 . . . . 0.0 117.472 -171.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.538 HG13 ' H ' ' A' ' 47' ' ' PHE . 5.0 pt -107.11 -75.1 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 121.479 -1.012 . . . . 0.0 109.514 -168.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.538 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -73.18 -5.63 40.49 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.145 1.778 . . . . 0.0 113.04 169.215 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -72.52 67.64 0.76 Allowed 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 127.121 2.169 . . . . 0.0 112.126 176.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.6 ptm -64.7 -32.35 73.98 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.816 1.646 . . . . 0.0 112.525 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.9 ptpp? -64.54 -47.55 78.39 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 121.481 -0.762 . . . . 0.0 112.419 175.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.06 -42.25 85.07 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.996 1.318 . . . . 0.0 112.288 176.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.7 mtp180 -53.71 -48.49 69.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 174.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -63.24 -48.31 78.77 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.712 -1.243 . . . . 0.0 112.749 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.425 ' HD3' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -50.61 -51.36 49.38 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 126.926 2.091 . . . . 0.0 113.706 176.063 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . 0.465 ' CZ2' ' HA ' ' A' ' 42' ' ' GLU . 17.9 t90 -73.18 -33.93 65.7 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.918 1.687 . . . . 0.0 112.715 -176.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -68.13 -34.41 76.3 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.742 -1.849 . . . . 0.0 111.837 177.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.87 -24.91 65.3 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.985 -1.072 . . . . 0.0 113.118 173.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.413 ' CE2' ' HB3' ' A' ' 32' ' ' LYS . 13.9 t90 -81.8 -51.23 8.35 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.599 1.56 . . . . 0.0 110.131 179.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -46.31 -38.55 8.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 129.938 3.295 . . . . 0.0 113.634 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -54.69 -33.25 60.61 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.357 -1.464 . . . . 0.0 114.437 176.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.5 mp -117.02 24.56 11.11 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.885 1.069 . . . . 0.0 113.885 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 pttt -63.16 3.53 0.26 Allowed 'General case' 0 N--CA 1.43 -1.439 1 N-CA-C 122.566 4.284 . . . . 0.0 122.566 -173.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -139.43 -28.17 0.23 Allowed Glycine 0 N--CA 1.429 -1.775 0 CA-C-N 121.801 2.091 . . . . 0.0 111.518 174.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 42.5 tttp -88.42 -28.16 21.08 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.594 -1.533 . . . . 0.0 113.907 -167.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 4.0 t -87.47 15.6 6.42 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 -152.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -68.7 -11.61 60.42 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 116.982 -3.573 . . . . 0.0 114.148 166.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -93.09 -38.06 11.81 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.243 2.217 . . . . 0.0 113.49 171.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -93.18 -49.24 6.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.028 -1.045 . . . . 0.0 113.344 -175.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HB3' ' HB2' ' A' ' 34' ' ' ALA . . . -42.5 -61.61 1.17 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.576 1.95 . . . . 0.0 114.253 176.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -42.36 -35.67 1.07 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 119.64 3.2 . . . . 0.0 119.64 169.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.0 mmtm -88.08 -41.05 13.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.065 -2.272 . . . . 0.0 112.248 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -76.52 -22.78 53.95 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.421 -1.424 . . . . 0.0 111.653 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -65.5 -58.95 4.56 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 124.854 1.262 . . . . 0.0 113.23 -178.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -38.98 -49.03 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.737 1.615 . . . . 0.0 115.345 172.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.75 -46.0 69.98 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 11.6 mt -56.62 -57.85 10.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.3 1.04 . . . . 0.0 111.298 173.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 12' ' ' VAL . 77.5 t -72.48 -20.05 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 125.319 1.447 . . . . 0.0 111.35 -171.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.62 -49.99 66.68 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 118.637 -2.54 . . . . 0.0 112.309 169.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -69.99 -27.2 64.51 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.852 1.661 . . . . 0.0 111.928 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.462 HD22 HD11 ' A' ' 27' ' ' LEU 0.356 9.3 mp -81.87 -45.46 15.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.374 2.269 . . . . 0.0 111.053 178.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 55.0 mt -61.19 -32.41 52.81 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 O-C-N 119.414 -2.054 . . . . 0.0 113.269 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -53.21 -29.37 31.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 170.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.24 -47.26 8.99 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.691 1.196 . . . . 0.0 112.485 166.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -90.52 -11.18 40.95 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.575 1.694 . . . . 0.0 115.575 -159.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 6.5 t -43.7 -54.3 5.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.358 2.263 . . . . 0.0 116.355 176.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 C--O 1.259 1.593 0 O-C-N 121.139 -0.976 . . . . 0.0 110.418 -176.543 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.515 HG12 ' H ' ' A' ' 4' ' ' LEU . 5.2 t . . . . . 0 CA--C 1.49 -1.365 0 N-CA-C 113.947 1.091 . . . . 0.0 113.947 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.0 p -67.92 -27.96 67.08 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 128.343 2.657 . . . . 0.0 114.469 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -64.62 -47.76 77.41 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.756 -1.215 . . . . 0.0 113.708 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' H ' HG12 ' A' ' 1' ' ' VAL . 64.3 tp -57.52 -48.84 78.2 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.085 2.154 . . . . 0.0 110.833 178.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 34' ' ' ALA . 1.8 t80 -45.59 -43.89 12.5 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.667 2.387 . . . . 0.0 111.904 174.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -78.52 -32.45 48.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.518 -1.364 . . . . 0.0 114.216 -178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -60.45 -51.81 67.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 123.678 1.704 . . . . 0.0 110.934 173.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 71.0 mmtt -88.96 -22.64 22.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-N 114.09 -1.414 . . . . 0.0 113.622 -168.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.419 ' HB1' ' CD1' ' A' ' 31' ' ' TYR . . . -66.93 -47.0 73.03 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.307 2.003 . . . . 0.0 113.515 175.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.0 mmtt -65.07 -20.46 66.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.077 1.751 . . . . 0.0 113.218 175.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.17 -58.06 3.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 123.926 0.89 . . . . 0.0 110.493 167.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.403 HG21 HD22 ' A' ' 27' ' ' LEU . 27.4 m -64.22 -27.61 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 O-C-N 119.96 -1.713 . . . . 0.0 113.974 -171.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.84 -18.72 62.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -127.42 7.52 6.4 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.039 1.336 . . . . 0.0 113.541 -172.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.491 ' HG ' ' HD2' ' A' ' 16' ' ' PRO . 1.5 tp -68.8 153.6 95.77 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 119.855 -1.778 . . . . 0.0 110.73 -175.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.491 ' HD2' ' HG ' ' A' ' 15' ' ' LEU . 82.1 Cg_endo -75.27 -17.52 18.9 Favored 'Trans proline' 0 C--N 1.301 -1.953 0 C-N-CA 122.948 2.432 . . . . 0.0 111.708 -169.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 85.1 m -107.28 78.27 1.21 Allowed 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.135 -3.283 . . . . 0.0 102.135 172.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 95.3 mttt -57.76 151.58 41.49 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 -176.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 85.2 Cg_exo -65.0 148.94 89.95 Favored 'Trans proline' 0 C--N 1.3 -1.993 0 C-N-CA 122.753 2.302 . . . . 0.0 114.949 -164.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.3 t -82.12 160.67 23.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.526 -1.358 . . . . 0.0 112.067 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 19.1 m -47.99 -59.87 3.04 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.126 2.57 . . . . 0.0 117.924 -162.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.91 -12.86 59.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.827 1.251 . . . . 0.0 113.403 -175.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -89.38 -43.89 10.58 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.574 1.95 . . . . 0.0 108.788 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.7 tt -53.28 -37.66 62.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.821 2.848 . . . . 0.0 114.556 171.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -40.01 63.18 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.761 -1.212 . . . . 0.0 112.934 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -67.44 -40.47 85.43 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.977 -1.702 . . . . 0.0 111.166 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.403 HD22 HG21 ' A' ' 12' ' ' VAL . 26.1 mt -56.05 -48.25 76.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.495 1.518 . . . . 0.0 114.021 166.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -55.01 -55.25 32.97 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.503 1.521 . . . . 0.0 111.99 173.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.5 -50.77 67.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 119.582 1.083 . . . . 0.0 112.931 -176.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 76' ' ' LEU . 3.8 mp -70.5 -38.87 74.38 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 115.529 1.677 . . . . 0.0 115.529 176.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.419 ' CD1' ' HB1' ' A' ' 9' ' ' ALA . 38.2 t80 -55.62 -58.41 7.9 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.223 1.009 . . . . 0.0 109.831 173.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -58.32 -35.81 72.43 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.948 -1.72 . . . . 0.0 113.689 176.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.46 -58.47 7.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 119.338 0.972 . . . . 0.0 113.121 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 5' ' ' PHE . . . -84.4 -15.34 46.65 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.098 -1.626 . . . . 0.0 113.379 -177.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 51.7 m -67.65 -62.42 1.42 Allowed 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.971 -1.08 . . . . 0.0 113.61 173.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.4 p -87.25 -38.87 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.957 -1.714 . . . . 0.0 112.24 175.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 120.79 -42.34 1.74 Allowed Glycine 0 N--CA 1.429 -1.801 0 O-C-N 120.779 -1.2 . . . . 0.0 113.278 176.093 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -128.82 171.94 11.78 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 -169.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 17.4 p-10 -60.54 124.53 20.65 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.1 -1.625 . . . . 0.0 113.786 158.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -103.08 -86.17 0.44 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 121.137 -0.977 . . . . 0.0 111.14 -175.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -84.67 81.93 8.64 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.639 -1.288 . . . . 0.0 113.843 -164.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -76.63 45.42 0.4 Allowed 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 125.117 2.389 . . . . 0.0 113.573 -175.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.22 81.01 2.35 Favored Pre-proline 0 N--CA 1.43 -1.47 0 C-N-CA 126.558 1.943 . . . . 0.0 107.852 178.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.71 152.4 69.54 Favored 'Trans proline' 0 C--N 1.299 -2.057 0 C-N-CA 122.473 2.116 . . . . 0.0 109.634 165.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -77.26 -123.72 0.24 Allowed Glycine 0 N--CA 1.431 -1.694 0 N-CA-C 119.425 2.53 . . . . 0.0 119.425 -160.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 47' ' ' PHE . 2.4 pt -116.89 -68.85 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 124.56 1.144 . . . . 0.0 111.698 -163.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.429 ' H ' HG13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -80.53 6.39 12.58 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.785 2.034 . . . . 0.0 112.073 169.706 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.451 ' HB3' ' HB2' ' A' ' 51' ' ' ASP . 24.8 m120 -81.39 60.28 4.38 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 128.073 2.549 . . . . 0.0 113.022 -174.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 49.5 tpp -69.35 -36.3 76.73 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.333 1.453 . . . . 0.0 113.063 -175.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -74.06 -40.84 62.52 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.912 -1.118 . . . . 0.0 110.557 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.451 ' HB2' ' HB3' ' A' ' 48' ' ' ASN . 5.2 m-20 -61.78 -38.99 90.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.631 1.172 . . . . 0.0 114.154 176.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -49.64 -39.42 35.99 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 170.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -77.98 -48.64 15.76 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.715 -1.241 . . . . 0.0 112.923 173.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -59.35 -42.38 91.42 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -177.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -67.22 -32.46 73.52 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.448 1.099 . . . . 0.0 111.439 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -73.68 -31.17 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.059 -1.651 . . . . 0.0 112.754 176.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.18 62.21 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.429 -1.419 . . . . 0.0 113.39 170.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -87.39 -47.49 8.74 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.262 -1.524 . . . . 0.0 110.55 178.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.77 -7.17 14.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.711 -1.868 . . . . 0.0 114.785 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -56.83 -37.74 71.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.623 -1.923 . . . . 0.0 112.066 162.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 8.4 mp -116.93 30.96 7.03 Favored 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 126.2 1.8 . . . . 0.0 113.1 -177.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -50.07 -33.21 17.67 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 120.628 3.566 . . . . 0.0 120.628 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -98.24 -47.22 2.06 Favored Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -159.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -115.38 -35.73 4.53 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-O 122.164 0.983 . . . . 0.0 112.397 -164.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.24 39.36 0.82 Allowed 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 -136.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -77.94 -39.07 43.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.612 1.565 . . . . 0.0 108.131 163.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -67.92 -33.59 74.99 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.009 2.123 . . . . 0.0 110.581 -179.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -83.46 -45.01 14.12 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 123.974 0.909 . . . . 0.0 111.652 172.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -42.97 -60.65 1.54 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -43.3 -43.93 5.19 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 118.471 2.767 . . . . 0.0 118.471 172.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.8 mttp -88.26 -19.82 26.28 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.448 -2.033 . . . . 0.0 115.914 -177.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -89.31 -28.57 19.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.692 -1.255 . . . . 0.0 110.952 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -64.27 -43.92 93.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.826 -1.171 . . . . 0.0 113.379 -175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 14.3 tt -39.28 -52.05 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 166.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.55 -22.84 56.7 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.436 HD11 HD13 ' A' ' 30' ' ' LEU . 89.4 mt -69.13 -63.38 1.07 Allowed 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.739 -1.226 . . . . 0.0 109.071 167.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.424 ' HA ' ' HB2' ' A' ' 80' ' ' LEU . 53.1 t -66.34 -24.77 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 C-N-CA 126.155 1.782 . . . . 0.0 111.087 -166.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -59.39 -44.81 92.72 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.028 -1.67 . . . . 0.0 114.163 171.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -82.0 -24.38 35.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-O 121.932 0.872 . . . . 0.0 111.852 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 77' ' ' VAL . 65.2 mt -71.44 -50.11 34.94 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.126 1.37 . . . . 0.0 109.487 175.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 65.7 mt -64.74 -33.48 63.64 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 O-C-N 119.484 -2.01 . . . . 0.0 112.738 176.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.36 -30.66 65.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.62 -1.925 . . . . 0.0 114.94 172.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 28.3 ttpt -87.25 -38.08 16.64 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.348 1.459 . . . . 0.0 111.392 173.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -106.58 -13.68 15.24 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -158.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 59.9 p -42.35 -54.99 3.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 -177.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.208 1.003 . . . . 0.0 108.932 172.305 . . . . . . . . 0 0 . 1 stop_ save_