data_2jtd_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 2jtd _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.511 -0.551 . . . . 73.54 109.511 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.474 ' HA ' HD22 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 75.31 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 75.21 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.01 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.712 ' HB1' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 65.35 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 71.13 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.484 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 75.33 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.32 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.24 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.04 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HZ3' ' CD ' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 71.32 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.696 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.44 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.696 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.15 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.54 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.6 HG12 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.22 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 73.42 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.31 109.599 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.739 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 75.31 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 64.5 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.6 ' HG2' HG12 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.41 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 63.55 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 70.13 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 74.12 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.45 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.32 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 73.41 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.685 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.32 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.23 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.35 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.795 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.45 110.625 -176.226 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.1 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.526 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.34 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.515 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.502 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.11 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.557 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.13 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.693 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 75.13 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 73.04 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.739 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 74.32 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.45 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.31 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 72.34 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 74.22 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 71.45 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.54 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.33 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.464 HG22 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.42 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 72.02 109.909 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.559 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.43 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.579 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.32 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 74.14 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 71.44 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.04 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.14 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 72.22 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.53 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.31 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.548 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 75.23 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 73.23 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.42 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.12 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.468 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.42 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.548 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.4 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.444 ' HE1' ' HB3' ' A' ' 67' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.13 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.46 ' HE2' ' HD2' ' A' ' 66' ' ' LYS . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.264 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.659 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.04 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.44 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 75.31 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.423 HD21 ' HA ' ' A' ' 72' ' ' ASN . 0.6 OUTLIER -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.51 110.549 -177.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.24 110.021 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.541 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.31 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.48 HG23 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.41 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.659 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 73.11 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.48 ' HG3' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.53 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.3 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.712 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.35 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 75.31 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.42 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 75.34 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.41 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 75.33 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.43 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 72.34 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 73.42 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 75.41 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.538 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.21 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.44 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.468 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 75.41 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.579 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.53 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.25 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 75.41 111.061 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.73 HD13 HD21 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 74.2 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.23 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 71.3 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.11 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 72.43 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 74.14 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 70.53 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.31 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 75.01 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 71.22 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 72.22 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 71.54 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 75.04 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.538 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.42 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 72.02 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.57 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 74.22 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.34 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.637 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 64.41 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.57 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.41 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.423 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.22 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.508 ' CA ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 70.13 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 73.2 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 72.31 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.4 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.685 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.43 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.34 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.446 0.165 . . . . 75.15 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 73.03 110.257 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.539 ' HD2' ' HG2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 74.45 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 74.52 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.31 111.349 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.402 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 64.31 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.22 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 64.24 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.11 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.553 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.34 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 73.33 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.779 ' HG3' ' HB3' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.04 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.01 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.11 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 73.53 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.672 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 64.53 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.672 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.11 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.42 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 72.41 110.374 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.32 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.556 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 72.02 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB3' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.31 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.23 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 74.02 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.415 HD11 ' N ' ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.11 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 75.0 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HA ' ' OE1' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 73.54 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.33 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.43 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 13.1 mm100 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.31 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 71.31 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 73.21 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 75.12 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 75.35 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.403 ' HB3' HD23 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.44 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.15 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 74.12 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.05 110.896 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.643 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 73.53 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 72.13 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.42 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.24 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.643 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.22 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 73.33 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 74.35 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.448 HG22 HG22 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.21 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.41 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 73.54 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.14 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.31 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.456 ' HB3' HG22 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 75.43 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.24 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 71.33 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 75.32 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.23 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.456 HG22 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.42 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.4 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.478 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.51 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 63.52 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 74.3 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.03 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.746 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.31 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.51 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.15 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 74.53 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.42 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 74.32 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 71.15 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.34 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.55 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.22 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 75.35 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.44 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.746 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 73.15 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.52 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 71.3 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.51 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.529 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 74.45 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.41 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.545 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 63.34 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.24 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 71.5 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.442 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.42 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.462 ' CD ' ' HZ2' ' A' ' 64' ' ' LYS . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.42 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.42 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 73.52 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 74.33 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 75.34 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.32 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 75.54 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.448 HG22 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.31 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.613 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.52 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.45 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.24 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 74.44 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 72.13 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.43 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG12 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.21 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.45 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.2 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.14 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.54 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.13 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.33 109.577 176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.54 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 64.21 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.625 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 73.15 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 71.33 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 74.32 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.625 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 71.11 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 74.23 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 72.13 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.534 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 74.11 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.24 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.44 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.15 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.459 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 53.25 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.446 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 62.44 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 121.081 0.467 . . . . 74.53 110.077 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.51 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.44 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.01 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.13 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.489 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 71.43 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.12 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.24 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.24 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.52 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 74.42 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.494 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.24 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.44 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 73.43 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.499 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 74.32 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.33 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.499 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 75.32 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.981 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 73.51 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.22 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.11 109.409 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.567 HD12 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.472 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 72.3 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.13 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.35 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 72.32 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.581 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.23 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 74.43 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 31' ' ' GLU . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.51 111.859 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 75.1 110.141 -176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.13 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 72.43 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.567 ' CE2' HD12 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.41 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 74.12 109.828 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.513 ' HB3' HD23 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 74.41 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 74.4 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 75.31 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.981 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.13 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.533 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 74.52 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.479 HD13 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 74.54 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.482 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 74.42 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.31 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.02 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.12 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 74.43 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.474 HG23 HG22 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.22 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.11 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.472 ' HH ' HG23 ' A' ' 76' ' ' ILE . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.54 109.285 175.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.675 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.55 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 73.03 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.22 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.31 112.194 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.01 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.1 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 74.4 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 72.42 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.533 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.23 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 71.31 112.358 -176.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 63.34 112.698 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.493 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 73.54 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.465 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.4 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.24 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.672 ' HE2' ' HE2' ' A' ' 78' ' ' MET . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 74.1 110.9 -175.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 73.22 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 75.55 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.5 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.14 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 72.23 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.42 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.479 ' CA ' HD13 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.33 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 72.12 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.472 HG23 ' HH ' ' A' ' 52' ' ' TYR . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 71.23 109.252 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.489 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.24 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.681 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 72.44 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 74.22 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 75.53 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 75.01 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 75.34 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 74.21 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 73.23 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.43 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.43 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.12 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.4 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.463 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 64.14 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 75.34 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 75.34 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.675 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 74.43 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.421 ' HZ ' ' HE3' ' A' ' 78' ' ' MET . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.32 111.146 -177.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.24 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.474 HG22 HG23 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 71.32 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.44 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.35 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 74.24 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.31 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 71.33 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.51 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 75.13 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.23 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 74.31 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.41 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.618 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 64.41 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.463 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.03 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 61.34 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.503 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 73.45 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.24 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.618 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.32 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.14 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 75.43 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.687 ' HB3' HD11 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 75.33 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.442 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.04 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.21 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.11 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.53 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.476 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.03 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.31 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' MET . . . . . 0.44 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.035 0.445 . . . . 74.32 110.721 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.23 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.51 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.466 ' H ' HD23 ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.53 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.12 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.533 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 73.01 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.423 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 64.14 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.41 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.42 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.3 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.14 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.24 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.572 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.24 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 75.24 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 73.21 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 75.34 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.422 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 73.34 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 20' ' ' PRO . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.24 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 73.23 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.24 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 72.21 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 73.32 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.32 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 51.31 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 74.4 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.456 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.4 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 74.22 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 71.23 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.41 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.24 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.573 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 26.3 tp60 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.54 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.05 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.533 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 75.32 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.01 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.33 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.552 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.22 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.51 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.04 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 70.13 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 73.13 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.811 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 74.34 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.811 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 65.32 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.45 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.44 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.31 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 72.11 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.44 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.01 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.434 ' HB3' HG22 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 74.41 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.1 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.53 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.54 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.24 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.32 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.54 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.456 ' CD ' ' HZ1' ' A' ' 66' ' ' LYS . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.55 109.993 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.55 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 74.34 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.4 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.697 ' HD1' ' HE2' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.21 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.456 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 71.32 109.459 173.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.33 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.05 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.89 HD11 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 71.13 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 65.03 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 74.4 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.53 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.42 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 55.43 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.423 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.53 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.89 HG12 HD11 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 60.34 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.567 ' SD ' ' HE1' ' A' ' 80' ' ' MET . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.22 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.14 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.697 ' HE2' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.43 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 61.43 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 75.3 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.43 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.33 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.43 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 64.12 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.601 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 74.44 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 75.44 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.44 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.51 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.523 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.1 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 65.43 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.42 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.05 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.32 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 73.22 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.52 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 75.33 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.11 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 75.1 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.401 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 73.05 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.02 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.14 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 72.3 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.601 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 75.01 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.52 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.62 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.21 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 71.15 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.436 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.32 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 74.41 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 73.43 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 71.13 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.456 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.51 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.31 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 73.15 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 62.12 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.11 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.774 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 71.43 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp . . . . . 0 C--O 1.231 0.098 0 N-CA-C 108.622 -0.881 . . . . 73.41 108.622 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 72.31 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.41 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 74.23 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.34 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.651 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 71.53 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.42 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.33 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 65.15 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 61.42 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 73.13 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.481 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.44 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.783 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.34 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.783 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 74.52 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.01 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.34 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.14 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.51 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 62.02 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 72.41 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.4 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.481 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.05 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.483 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 75.24 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.24 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.31 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.14 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.516 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 72.33 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 73.14 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 73.5 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HD2' ' H ' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 73.24 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 73.22 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.34 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 71.15 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.547 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.24 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.483 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 60.23 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.57 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 73.11 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.488 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 75.43 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.42 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 71.41 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.53 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 74.32 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.24 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 71.5 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.13 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.24 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.23 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.5 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.21 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.52 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.32 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 74.24 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.689 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.34 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.14 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 74.0 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 74.23 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 71.43 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.34 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 65.35 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.32 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.54 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.403 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.11 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.34 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.02 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 75.44 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.506 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 74.54 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 73.31 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.24 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.527 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.3 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.21 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.51 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 62.15 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 75.02 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 75.42 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.641 ' HE2' ' SD ' ' A' ' 80' ' ' MET . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 71.34 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.13 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.641 ' SD ' ' HE2' ' A' ' 78' ' ' MET . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 65.2 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.436 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.42 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.436 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 65.25 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 73.42 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.57 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 26.4 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 75.42 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 87' ' ' ASP . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.13 110.556 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.33 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.57 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 74.0 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.03 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.404 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 75.14 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.406 HG22 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.45 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 75.12 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.689 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.23 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.35 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.52 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 75.22 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.51 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HA ' HG21 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.12 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.51 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.14 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 100' ' ' ALA . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 65.12 111.397 174.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 72.4 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.424 ' H ' ' C ' ' A' ' 98' ' ' GLY . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 74.21 110.046 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.53 HG21 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 55.34 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.42 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.32 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.53 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.53 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.33 109.168 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.406 ' HB ' HG22 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 74.31 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.41 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.404 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 75.5 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.41 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 71.51 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.32 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 74.13 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 74.52 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.02 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 73.4 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.13 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.53 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 72.23 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.22 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 74.14 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.519 0.199 . . . . 74.43 111.252 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.52 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.21 109.894 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 74.14 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.22 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.426 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 74.21 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.44 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 74.34 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.11 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.23 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.82 ' HZ1' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.42 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.559 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.34 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.43 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 72.13 110.015 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 21' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 74.02 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 74.34 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.454 ' H ' ' C ' ' A' ' 19' ' ' VAL . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.05 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.763 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.45 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.31 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 71.21 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.66 HD12 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 72.04 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.82 ' HB2' ' HZ1' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.1 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.42 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 75.32 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 73.03 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 74.52 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.03 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 65.3 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.12 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.44 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.31 111.239 -176.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.32 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.02 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 74.13 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.494 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.32 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.12 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.428 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.24 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.763 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.12 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.01 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.405 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 73.3 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 71.45 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 75.11 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.13 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.2 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.52 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.43 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.11 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 70.34 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.42 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.04 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 4.0 t-20 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.53 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.45 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.44 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.422 ' HG3' HD11 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.22 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.55 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.33 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.14 109.592 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 74.11 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.53 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.56 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.2 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.24 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 73.31 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.15 110.339 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 74.34 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 75.41 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.32 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.43 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 75.1 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.01 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.34 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.12 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.53 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.459 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.15 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.45 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.54 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 75.12 112.074 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.12 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.466 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.52 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 75.02 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 73.03 112.447 -174.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 75.14 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.22 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.56 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.53 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.21 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 74.42 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 74.34 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.406 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 72.01 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 74.34 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 75.51 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 73.22 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.24 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 72.15 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.35 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 75.21 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.42 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 73.34 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 72.55 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 73.14 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.66 ' HB2' HD12 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.3 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.14 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.01 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 75.55 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 73.4 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 73.2 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.34 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.45 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.45 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.479 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.44 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 73.34 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 60.11 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 73.42 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 31' ' ' GLU . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.43 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 74.14 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 75.14 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.33 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.414 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 74.41 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 75.12 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 120.873 0.368 . . . . 75.15 111.37 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.12 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.668 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.24 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.23 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 72.21 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.44 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 71.13 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.412 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.43 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.437 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.54 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 75.04 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.34 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.464 ' HE2' ' HB3' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 75.15 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.604 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 65.14 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.604 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.42 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 73.34 110.617 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 75.04 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 74.02 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 54.25 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.726 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.34 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.03 109.204 173.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.926 HD21 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.13 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.464 ' HB3' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 75.14 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 72.3 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.493 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.43 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 71.3 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.614 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 74.53 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.32 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.426 HE22 ' HB3' ' A' ' 81' ' ' GLU . 17.3 mm-40 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 73.23 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.3 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.501 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.41 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.22 108.415 172.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.437 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.15 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.451 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.2 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.726 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 73.5 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.41 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.519 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 75.12 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 74.03 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.54 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.424 ' C ' ' H ' ' A' ' 47' ' ' ASN . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.41 110.077 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 52.25 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 45' ' ' SER . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 74.33 110.277 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.02 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 75.41 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 73.03 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.34 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 72.41 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.35 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 74.55 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.55 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.22 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.33 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.15 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 75.12 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.43 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.11 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 73.21 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.45 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 73.31 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.415 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.44 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 72.32 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.3 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.571 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 73.02 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 75.1 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 73.33 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.654 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 75.44 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.453 ' N ' HD21 ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.13 107.121 167.534 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 62.54 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.42 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 73.05 110.222 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.4 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.571 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.45 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.22 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.668 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.5 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.426 ' HB3' HE22 ' A' ' 34' ' ' GLN . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.43 108.453 170.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 71.21 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 75.32 107.966 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 65.11 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.41 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.23 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.34 109.41 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.621 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.53 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.41 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.31 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.01 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.463 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.3 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 61.52 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.24 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.926 HD11 HD21 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.53 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 74.41 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.519 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 75.14 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 75.13 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.21 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 75.52 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 72.13 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.21 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.33 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.51 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.33 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 65.42 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.24 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.621 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 74.35 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 73.35 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.51 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.13 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 74.05 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.625 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.14 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 64.13 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 74.14 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 75.24 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.625 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 71.33 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.23 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.45 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.413 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.51 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm . . . . . 0 CA--C 1.53 0.178 0 N-CA-C 111.753 0.279 . . . . 75.52 111.753 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.11 111.457 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.465 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 73.41 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 73.43 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 72.55 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.785 ' HB1' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 65.11 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.1 108.823 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.2 109.931 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.34 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.439 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.21 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 72.04 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.647 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 74.02 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.493 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.24 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.647 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.21 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.461 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 62.0 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.973 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.21 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.973 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.45 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.1 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 74.21 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.3 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.461 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 74.42 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.14 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.23 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.54 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.32 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 72.32 110.574 -176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.54 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.495 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.23 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 73.32 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 65.41 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.718 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.42 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 74.34 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.22 110.077 -178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.55 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.608 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 74.43 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.464 ' HB3' HD23 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.33 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.35 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 73.32 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.42 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.45 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.556 HD11 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 73.1 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.34 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 71.23 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.34 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.41 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 74.03 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.1 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.23 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 75.14 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.478 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 74.24 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.415 ' HB3' HG21 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.42 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 64.52 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 72.13 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 75.52 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 73.44 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.415 HG21 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 73.41 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.23 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.23 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.11 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.505 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.31 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.21 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.465 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 73.34 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.21 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.04 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.55 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.43 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.52 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.8 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 74.24 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 75.34 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 73.44 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 71.03 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 73.44 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.55 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.24 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 72.01 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.515 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.33 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.785 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.4 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.1 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.718 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 72.43 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.42 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.05 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.21 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.11 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 71.13 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 74.14 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.15 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.505 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.22 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.566 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 63.14 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.2 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.3 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.478 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 74.44 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.11 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.35 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.51 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.43 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.43 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 73.35 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.939 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.1 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.11 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.15 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.422 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 73.44 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.2 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 73.01 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 73.33 109.339 -177.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.509 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.3 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.558 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.41 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.566 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 71.1 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.03 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.22 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.11 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.558 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.52 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 74.13 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.518 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 72.44 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 72.23 110.735 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.495 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.31 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 71.42 111.725 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 72.24 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.54 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 62.21 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.12 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.682 0.277 . . . . 72.2 110.886 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.24 110.671 -178.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.32 110.415 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 74.53 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.51 ' HB1' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.45 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 74.21 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.35 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.53 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.45 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.45 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.736 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 72.44 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.736 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 75.41 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 74.12 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 60.21 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.606 HG23 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.22 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.32 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 75.14 110.003 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.632 ' HB3' HE22 ' A' ' 40' ' ' GLN . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.11 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.474 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.42 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 74.3 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 74.2 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.429 ' N ' HD13 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 63.24 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.696 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 70.34 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 72.21 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 74.13 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.31 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.696 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.52 110.036 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.15 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.417 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.31 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.474 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.23 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.596 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 73.12 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.22 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.632 HE22 ' HB3' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.12 110.646 -178.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 72.33 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.475 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.21 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.52 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.23 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.13 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 75.12 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.51 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.52 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.23 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 73.45 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 65.55 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.41 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.775 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.11 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 74.32 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 72.55 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.05 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 61.41 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.44 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 72.22 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 73.44 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 73.4 109.715 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 73.24 113.26 -173.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.23 113.586 -175.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.991 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 75.13 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.598 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 73.43 109.458 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.24 109.65 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.437 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.41 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.22 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.15 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 75.2 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.766 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 74.22 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.42 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.23 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 63.21 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 74.42 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.33 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.51 ' OE1' ' HB1' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.33 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.54 ' SD ' ' HE2' ' A' ' 80' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.32 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 75.3 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.598 ' HE3' ' HA ' ' A' ' 65' ' ' TYR . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 72.02 110.875 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.33 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.587 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 65.12 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.991 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 71.53 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.32 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 74.35 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.24 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.486 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.31 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.03 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.488 ' HA2' HG22 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.4 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 75.42 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 73.33 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.775 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.13 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 75.44 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.33 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.1 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.451 ' O ' ' HB1' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.41 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.53 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 73.21 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 71.02 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 74.24 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 73.03 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.03 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 74.21 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.52 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 74.54 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 74.52 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.32 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.2 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.488 HG22 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.34 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.04 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.713 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 45.52 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.4 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.21 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 72.42 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.14 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 74.33 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.441 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 7.5 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 74.21 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 72.14 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.23 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 71.01 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.15 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 74.3 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.33 112.593 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 72.32 112.16 -170.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 75.43 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 61.51 110.5 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.41 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.33 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.31 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.57 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.43 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.01 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.34 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.12 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.43 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.681 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 72.04 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.44 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 64.41 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.453 HG21 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 74.14 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.43 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.453 ' H ' HG21 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 72.24 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 75.13 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.41 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.31 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.584 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 73.51 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.31 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 74.3 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 74.13 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.531 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 75.21 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.456 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 74.24 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 117' ' ' GLN . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 70.21 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.32 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.477 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 9.4 mm100 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 74.51 112.188 -162.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.57 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 70.51 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.584 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.55 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 73.13 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.491 ' HB3' HD23 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.21 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.41 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 75.12 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 74.41 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.44 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 74.04 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.03 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 63.32 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.35 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.42 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 75.24 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.501 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 74.31 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.41 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.543 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.11 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.601 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.32 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.43 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 75.5 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.41 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.11 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 75.33 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 75.24 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 74.52 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.476 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 74.13 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.13 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.507 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 74.42 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.417 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.476 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 75.21 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 71.13 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 75.44 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.43 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.3 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.22 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 73.31 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.43 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.51 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.42 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.457 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 74.2 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 74.03 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 72.24 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 73.55 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.56 ' HE3' ' CE2' ' A' ' 91' ' ' TYR . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.12 111.65 -175.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.477 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.34 109.749 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.422 ' HA ' ' OE1' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 74.3 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.444 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.444 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 74.03 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.41 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.31 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.507 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.33 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.43 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 75.15 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 75.11 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.56 ' CE2' ' HE3' ' A' ' 80' ' ' MET . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.44 109.882 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.601 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.11 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.04 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 55.43 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 62.52 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.35 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 74.54 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 75.13 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 74.32 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.33 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.14 111.975 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 65.44 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.584 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.12 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 74.34 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.51 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.546 HG13 HG12 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 74.11 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 74.41 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.3 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.01 111.35 -176.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.546 HG12 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 75.11 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.02 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.33 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 74.41 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 73.14 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.531 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 72.4 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.41 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.21 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 75.14 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.45 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 74.12 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 112.031 0.382 . . . . 74.31 112.031 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 74.55 111.202 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 73.13 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 73.44 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.52 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.23 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.418 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 72.42 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.23 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.32 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.456 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.02 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.01 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 72.04 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.12 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 62.23 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 72.43 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.464 HG12 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.44 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 74.51 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.464 ' O ' HG12 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 74.33 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.573 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 75.31 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 71.23 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 75.23 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.783 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 74.13 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 73.43 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 73.31 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 74.41 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.44 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.13 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.622 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.24 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.622 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.44 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.43 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 9.4 mm100 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 74.42 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 73.01 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 72.21 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.536 ' CZ ' HD22 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.54 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.41 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HB3' HD21 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 74.51 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.456 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 74.51 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.573 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 74.34 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.474 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.33 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 72.44 109.381 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 73.33 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.2 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.23 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.01 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 72.51 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 74.34 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 73.3 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.516 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 70.42 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.676 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 74.43 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 75.31 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.13 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 74.31 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 72.24 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.35 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.15 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.14 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.31 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.412 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.41 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 55.13 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.441 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.33 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.496 ' HB3' ' HE3' ' A' ' 67' ' ' MET . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 73.5 110.59 -178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 72.24 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.537 ' HE1' ' SD ' ' A' ' 78' ' ' MET . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.51 111.162 -175.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.43 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 74.43 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.51 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.13 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 74.53 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 74.35 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 61.23 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 74.3 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.02 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 75.25 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.537 ' SD ' ' HE1' ' A' ' 67' ' ' MET . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 74.52 109.32 177.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.23 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.513 ' HE2' ' HE3' ' A' ' 78' ' ' MET . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.1 110.766 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.31 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.409 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.31 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.24 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.535 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 74.43 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.535 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 74.05 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.456 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 73.42 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.441 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 54.14 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 75.33 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.44 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.31 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.22 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.676 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.01 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.516 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 74.23 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.21 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.469 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 74.12 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.14 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.41 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 73.4 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 75.21 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.61 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 75.15 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 72.14 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.3 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 74.54 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.783 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 72.42 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.41 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.41 109.112 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 71.25 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 65.5 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.03 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 64.32 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.43 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.43 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.536 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 72.1 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.13 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.04 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 73.24 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.54 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.463 ' HZ3' ' HB3' ' A' ' 118' ' ' LYS . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.21 111.687 176.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.52 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 62.1 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.04 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.52 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.688 0.28 . . . . 72.43 111.058 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.54 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 72.21 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 72.32 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.31 110.396 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.473 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.526 HD23 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 73.43 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.32 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.11 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 75.34 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.03 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 74.14 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 75.22 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 65.41 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.4 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.759 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.34 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.759 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.52 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.14 111.087 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.787 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 74.33 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.34 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.22 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 74.42 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 74.11 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 74.12 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.51 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 74.13 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.53 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 73.0 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 73.31 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.425 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.34 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.59 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.45 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.13 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.12 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.538 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 72.31 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 74.42 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.542 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 73.24 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 74.41 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.32 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.787 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 74.42 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.571 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 72.22 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.2 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 72.41 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 65.2 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 73.51 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.21 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.04 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.412 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.43 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 63.12 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.541 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.64 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.43 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.12 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.55 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.44 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 75.43 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.11 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.15 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.419 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.33 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.14 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.33 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.799 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 74.42 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.11 111.029 -170.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.508 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.22 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.41 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 73.04 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 75.43 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 72.04 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.34 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.12 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 73.32 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 72.33 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.519 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 75.12 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.526 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.43 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 72.1 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 71.43 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.572 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.22 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 73.05 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.01 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.799 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 65.22 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 64.13 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.21 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.32 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.2 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 75.15 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.22 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 75.3 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.572 ' HE2' ' HE2' ' A' ' 80' ' ' MET . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.03 109.227 173.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 71.44 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.541 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.01 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.02 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.518 HD13 HD21 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 70.32 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.42 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.497 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.34 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.51 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.14 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 71.11 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 75.13 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.21 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.419 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.1 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.41 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.45 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 74.34 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 74.41 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.31 110.297 178.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.451 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 73.14 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 72.2 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.52 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 73.21 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.15 112.437 -175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 63.35 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.13 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 74.24 110.497 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 72.24 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 74.25 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.23 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.43 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.42 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.815 0.672 . . . . 72.3 112.815 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 74.21 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.444 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 73.54 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 73.43 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.21 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.41 110.99 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.52 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 65.31 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.13 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 74.04 109.715 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.43 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 74.4 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.598 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 75.52 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.32 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 74.54 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 73.11 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.15 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.44 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.35 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.24 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 75.23 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 73.02 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.13 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.21 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.3 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 74.44 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 64.54 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.433 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 74.24 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.43 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.33 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 12.1 mm100 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.34 111.984 -169.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.55 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.57 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 75.33 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD22 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 74.11 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.44 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 50' ' ' VAL . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 74.24 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 74.22 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.42 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.24 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.422 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.52 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.566 HD21 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 72.45 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.443 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 74.21 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 70.44 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 71.14 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.44 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 75.22 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.487 HG22 ' HE3' ' A' ' 39' ' ' MET . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.13 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.582 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 74.1 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.33 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 71.43 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 75.34 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.51 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.14 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.483 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 70.2 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.41 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.523 ' CD ' ' HZ2' ' A' ' 66' ' ' LYS . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 75.45 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.22 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.51 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.554 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.52 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.53 109.9 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.53 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.4 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.13 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.41 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.35 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.54 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.21 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.566 ' CA ' HD21 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.3 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.53 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 75.53 109.125 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 74.41 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.24 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.444 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.55 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.489 ' SD ' ' HE1' ' A' ' 78' ' ' MET . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.51 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 73.34 110.699 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.488 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 71.32 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.839 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.33 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.53 109.735 178.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.839 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.22 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.34 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.576 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.23 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.53 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.489 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 73.01 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.582 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.33 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 74.23 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.467 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.41 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.581 HD13 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 75.14 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.685 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.01 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 72.01 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.44 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.52 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.23 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.24 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 65.02 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 10.2 p80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.45 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.474 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.15 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 74.31 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.409 HD12 ' HG ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 74.21 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.54 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.45 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.409 ' HG ' HD12 ' A' ' 106' ' ' LEU . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 71.33 110.287 177.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.576 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 75.24 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.15 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.4 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.41 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.619 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.22 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.35 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.41 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 72.41 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 71.24 110.699 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.619 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.42 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.04 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.41 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 72.4 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.23 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.499 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 72.42 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.42 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.882 0.372 . . . . 74.14 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.513 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 75.34 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.41 109.124 172.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.517 HD13 ' H ' ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 73.24 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 75.51 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.35 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.427 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.31 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.472 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 75.55 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 72.54 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 73.11 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.41 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HB2' HG21 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.33 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.593 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.42 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.593 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.11 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.528 HG21 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.23 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.538 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.4 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.538 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 74.3 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.464 ' HB ' ' HB1' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 73.25 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 74.43 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.44 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 73.24 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.496 HD23 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.14 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.41 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.55 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 75.51 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' A' ' 32' ' ' LYS . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.43 109.019 177.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 64.31 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 30' ' ' LEU . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 74.12 110.013 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 73.42 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.15 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.14 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.54 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.496 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.55 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.417 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 74.52 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.535 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 73.44 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 72.32 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.15 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.703 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.45 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.562 HD13 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.24 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 65.51 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.13 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.45 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.43 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 70.14 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.522 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 75.54 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.35 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 75.1 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HB3' HG22 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 75.51 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 73.34 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 73.51 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 74.11 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 73.41 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 75.41 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.15 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.03 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 73.42 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 71.25 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.43 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.1 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.12 109.182 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.3 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . 0.409 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.41 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 74.24 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.41 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.5 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.562 ' HA2' HD13 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 50.23 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.41 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.535 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.01 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.65 ' HE1' ' HZ ' ' A' ' 93' ' ' PHE . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.13 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.456 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.31 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.491 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.24 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.52 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.02 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 71.33 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 73.45 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 74.22 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.13 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.494 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.51 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.32 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.501 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.2 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.2 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.466 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.43 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.65 ' HZ ' ' HE1' ' A' ' 78' ' ' MET . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.34 110.508 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.522 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.52 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.12 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.24 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.44 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 74.22 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.12 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.464 ' HB1' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 72.34 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.01 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.23 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.35 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.15 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.34 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 73.32 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 74.5 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 65.22 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.501 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 74.13 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.1 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.663 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.51 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.411 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 71.45 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.43 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.663 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 75.25 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 74.43 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.34 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.601 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.55 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.22 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 75.32 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 71.24 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 74.43 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.43 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 121.099 0.476 . . . . 75.32 110.605 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 74.54 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.43 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 75.22 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 74.33 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.456 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 72.12 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.04 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.44 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.24 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.43 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HA ' ' HH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 72.31 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 72.11 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.492 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.43 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 73.02 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.726 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 75.51 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 73.45 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.4 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.4 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.22 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 71.34 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 74.54 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.15 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.568 HD23 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.33 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.54 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.11 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.23 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 72.53 110.384 -175.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 72.05 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.805 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.35 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 75.35 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.4 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.846 ' HA ' HE21 ' A' ' 34' ' ' GLN . 0.0 OUTLIER -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 71.35 110.292 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 75.32 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.534 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.44 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 75.42 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.418 ' HH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 74.35 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.563 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.44 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.11 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.12 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.54 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.41 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 72.53 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.44 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 72.12 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 45.23 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 74.42 110.108 -176.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.579 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 64.05 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.34 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 73.54 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.24 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.478 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 75.34 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.22 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 75.4 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 74.42 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.23 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.23 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.15 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 73.35 110.49 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.21 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.14 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.563 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 74.31 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 75.31 111.26 -176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 74.41 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.3 111.479 -169.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.22 109.702 177.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 73.34 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.44 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.53 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 75.23 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.31 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 65.11 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 75.55 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 75.22 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.474 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.55 110.614 176.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.533 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.03 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.04 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.447 ' SD ' ' HE1' ' A' ' 78' ' ' MET . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.54 112.598 -172.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.563 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.31 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 75.32 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 75.12 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.15 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.2 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.474 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.54 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.45 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.546 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.21 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 74.52 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.31 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 74.35 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.494 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 65.43 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.15 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.579 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.44 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.15 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.34 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.15 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.627 ' HZ2' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 74.42 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 63.04 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.23 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.13 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 73.55 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.23 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.32 108.968 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.11 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 74.2 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.546 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.54 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.33 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.41 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 74.35 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.541 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 71.31 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.32 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.2 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 74.32 110.513 177.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.35 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 118' ' ' LYS . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.4 111.489 -179.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.32 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 74.11 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.805 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 75.02 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 71.43 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.099 0.476 . . . . 73.03 110.485 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.44 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 71.12 111.328 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.2 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.34 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.549 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.24 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 74.12 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 70.21 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.3 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.42 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.14 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.41 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.695 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.2 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.695 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.31 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 72.24 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 75.42 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.42 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.411 HG23 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 74.34 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 75.4 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' HG23 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.23 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 74.21 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.698 HD22 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.34 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 71.55 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 74.54 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 73.15 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 72.41 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.53 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.643 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.42 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.643 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.01 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 70.22 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.442 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.3 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 74.24 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 74.35 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.698 ' CZ ' HD22 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.32 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.53 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 73.34 110.21 177.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.02 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.35 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.32 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.42 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 74.35 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 70.1 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.43 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.03 109.169 172.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.662 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.31 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 73.41 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.436 HG23 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 73.23 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 70.31 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.31 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.616 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.04 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.21 109.268 173.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 t-20 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.43 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.51 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 73.22 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.02 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 75.33 112.126 -173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.02 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.51 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.41 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.2 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 74.01 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.695 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 75.21 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.523 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.15 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.567 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.44 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.539 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 75.41 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.487 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.33 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.24 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.32 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 71' ' ' ARG . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 74.42 109.726 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.41 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.45 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.33 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 73.21 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 63.23 110.001 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.487 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.52 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 74.14 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.23 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 73.44 111.74 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.44 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.515 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.51 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.413 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.52 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.413 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 26.9 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.12 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.11 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.44 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.695 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.518 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.11 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.15 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.01 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.616 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.22 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 74.2 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.2 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.15 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.662 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 75.21 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 74.24 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 64.42 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.42 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.14 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.34 111.296 177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.22 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.43 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 60.23 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 64.22 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 73.52 108.849 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.44 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.5 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.3 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.518 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 75.42 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 44.53 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.33 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 71.43 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.03 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 75.44 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.45 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 75.34 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.507 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.33 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.32 111.079 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 71.44 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 61.22 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.49 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 74.31 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 75.12 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.614 0.598 . . . . 75.34 112.614 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 74.42 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 73.13 111.353 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.2 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.43 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 73.51 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 75.42 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.04 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 74.31 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.24 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.32 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.702 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 75.43 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 74.45 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.13 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 74.2 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.435 HG21 ' HD2' ' A' ' 20' ' ' PRO . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 75.22 109.741 -176.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.435 ' HD2' HG21 ' A' ' 19' ' ' VAL . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 64.1 113.128 177.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 72.12 109.203 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.14 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 74.2 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.702 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.2 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.66 HD21 HD13 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 73.14 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.31 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 75.45 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 74.43 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 74.12 110.898 -175.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.24 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.02 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 73.52 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 51.14 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.689 ' HA ' HE21 ' A' ' 34' ' ' GLN . 0.0 OUTLIER -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 75.31 110.292 178.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.51 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.477 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.32 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.504 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 74.0 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.13 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.52 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.22 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.31 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.483 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 75.44 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.483 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 74.02 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 73.55 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 74.22 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 74.3 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.35 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 72.03 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 74.33 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.14 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.435 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 71.11 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.583 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 72.11 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.794 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 75.13 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.444 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 73.02 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.22 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.34 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 74.11 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.583 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.34 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.444 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.41 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 71.22 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 61.15 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.43 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.21 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.23 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.04 109.414 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.14 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.45 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 74.5 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 73.31 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.14 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.84 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 74.15 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 74.33 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 74.05 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 74.11 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 74.51 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.479 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 73.13 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 74.22 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 80' ' ' MET . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 62.23 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.32 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.507 ' HE3' ' SD ' ' A' ' 78' ' ' MET . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.21 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.535 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 54.54 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.3 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.22 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 71.53 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.21 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.24 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.31 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 64' ' ' LYS . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.2 109.54 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.43 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.43 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 75.12 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.794 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 75.41 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.31 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.35 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.66 HD13 HD21 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.1 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.12 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.556 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.43 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.04 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.34 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.556 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.33 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.33 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.21 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 71.53 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.32 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 65.12 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 74.13 108.756 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.41 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 64.21 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.14 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 74.44 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.552 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.2 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.21 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.572 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.01 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.43 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 70.45 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.31 110.023 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.572 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 0.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.41 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 63.52 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.41 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 62.02 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.34 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.12 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.463 0.207 0 N-CA-C 112.004 0.372 . . . . 71.43 112.004 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.567 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 73.24 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 75.12 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 73.24 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 74.22 110.637 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 70.04 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.01 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.11 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 73.41 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 73.1 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 74.15 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.12 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.42 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.13 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.946 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.42 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.946 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 71.1 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.667 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 74.34 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.742 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 60.33 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.1 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.1 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.14 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 70.35 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.24 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.632 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 74.22 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.513 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 74.04 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.45 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.905 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 75.24 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.31 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 64.33 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.51 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.41 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.51 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 73.41 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.55 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.432 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 72.24 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 74.31 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 75.24 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.742 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 73.22 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.454 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 65.13 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 75.23 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.53 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.41 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.52 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.625 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 65.04 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.15 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.52 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.31 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.533 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 70.23 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.626 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 74.42 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 72.14 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.33 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 73.45 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 73.01 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.42 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 73.15 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.33 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.13 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.11 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 51.34 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.751 ' HG2' HD23 ' A' ' 83' ' ' LEU . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 75.4 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 74.42 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 72.52 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.33 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 73.1 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.43 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.22 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 75.3 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 71.32 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.13 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 45.24 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 73.14 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.432 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 74.55 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 61.51 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.61 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.3 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.567 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 72.12 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.14 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.439 ' C ' HD21 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 74.32 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.751 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 75.21 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.03 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.01 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.04 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.734 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.31 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.22 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.551 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 70.11 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 73.04 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.419 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 72.33 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.626 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 75.04 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.533 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.2 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.13 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.446 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.12 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.625 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 75.23 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.637 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.34 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.22 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.44 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.21 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.24 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.503 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.12 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 52.24 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 74.22 108.783 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.43 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.558 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 65.42 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.551 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 63.41 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.02 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.34 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 73.21 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.558 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 74.32 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 74.13 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 73.31 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 72.22 110.822 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.905 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.03 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.54 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 73.14 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.44 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.517 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 75.45 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.31 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.234 0.238 0 N-CA-C 112.518 0.562 . . . . 74.11 112.518 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.21 110.864 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 75.12 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.21 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.23 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.4 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.34 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 64.23 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.54 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.45 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.14 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 74.21 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.35 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.34 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.13 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.772 HG23 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 74.11 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.53 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.51 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.424 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.42 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.675 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.43 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.772 ' HB2' HG23 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 54.32 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.465 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 74.54 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.431 ' N ' HD11 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.24 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 72.45 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 74.24 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.588 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 73.53 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 74.32 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.648 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.45 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.648 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 71.43 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 74.03 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 74.12 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.22 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.03 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 75.03 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.35 111.203 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 72.5 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.53 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.21 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.23 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.534 ' HB2' ' HZ1' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.23 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.51 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.32 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.13 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 62.51 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.12 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.34 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 64.55 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.11 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . 0.446 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.14 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.537 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 75.14 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.582 ' HB2' HD11 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 74.44 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 74.32 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HA ' HG22 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 74.34 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.32 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.582 HD11 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 75.03 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.22 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.24 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.436 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.33 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.15 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.1 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HD1' ' SD ' ' A' ' 78' ' ' MET . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 73.55 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.4 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 71.15 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 75.31 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.02 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.12 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.01 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.52 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 71.24 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.425 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.1 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.451 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.43 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.41 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.595 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 71.22 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 60.03 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 74.45 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 75.2 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.14 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.418 HD11 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 75.53 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.14 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 74.31 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 75.52 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 71.34 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 64' ' ' LYS . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 72.32 107.502 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.57 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.32 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 70.05 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.44 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.11 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.625 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.24 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.48 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 74.23 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.33 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 74.25 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.42 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.675 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.3 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 75.4 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 63.53 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 75.31 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 74.23 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.04 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 75.15 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.625 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.34 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 74.21 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.23 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 75.44 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.471 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.53 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.57 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 73.0 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.22 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.627 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.42 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.11 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.471 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.11 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 75.01 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 73.34 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 74.21 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.535 HE21 ' N ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 64.21 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.22 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.42 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.588 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 73.25 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.487 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 71.25 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.32 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.963 0.411 . . . . 74.14 110.719 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.41 110.252 176.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 75.51 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.35 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.631 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.31 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 75.55 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 72.54 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.405 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 73.11 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.41 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.33 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.408 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.42 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.408 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.11 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.23 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' THR . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.4 110.144 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 74.3 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 73.25 108.508 171.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 74.43 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.44 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 73.24 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.61 HD23 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.14 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.484 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.41 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.55 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 75.51 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.428 HD11 ' N ' ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.41 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.43 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 64.31 112.113 -174.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 74.12 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 73.42 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.423 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.15 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.14 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.54 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.61 ' HZ ' HD23 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.55 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.484 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 74.52 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.826 ' HE3' HG22 ' A' ' 50' ' ' VAL . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 73.44 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 72.32 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.15 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.459 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.45 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.412 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.32 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.514 HD11 ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.51 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.453 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.24 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 65.51 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.13 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.562 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.45 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.43 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.826 HG22 ' HE3' ' A' ' 39' ' ' MET . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 70.14 109.869 174.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 75.54 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.35 108.814 173.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 75.1 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 75.51 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 73.34 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.445 ' HA ' HG21 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 73.51 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 74.11 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 73.41 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 75.41 111.029 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.15 110.319 -176.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.03 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 73.42 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 71.25 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.712 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.43 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.1 109.582 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.12 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.3 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.41 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 74.24 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.991 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.5 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 50.23 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.41 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.472 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 72.32 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.01 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.46 ' HE2' ' CG ' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.13 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.31 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.423 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.24 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.52 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.02 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 71.33 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 73.45 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.413 ' C ' ' H ' ' A' ' 87' ' ' ASP . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 74.22 109.662 173.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.13 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.51 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.32 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.495 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.2 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.2 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.712 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.54 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.452 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.43 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.34 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.52 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.12 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.562 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.24 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.44 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 74.22 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.12 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 72.34 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.01 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.23 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.35 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.15 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 72.34 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 73.32 110.669 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 74.5 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 65.22 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . 0.495 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 74.13 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.1 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . 0.624 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.51 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 71.45 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.49 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.43 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 75.25 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 74.43 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.405 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.34 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.55 111.765 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.22 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 75.32 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.408 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 71.24 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.43 110.289 -177.942 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.726 0.298 . . . . 73.31 110.673 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -166.59 -56.25 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.803 -0.635 . . . . 74.3 109.319 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.524 ' OE1' ' HD2' ' A' ' 66' ' ' LYS . 25.2 mm-40 -74.51 83.62 2.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.547 -0.751 . . . . 72.24 111.362 178.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm -76.51 -31.46 57.71 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.511 -0.551 . . . . 73.54 109.511 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.474 ' HA ' HD22 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 75.31 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 75.21 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.474 HD22 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.01 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.712 ' HB1' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 65.35 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 71.13 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.484 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 75.33 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.32 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.24 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.04 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.423 ' HZ3' ' CD ' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 71.32 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.696 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.44 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.696 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.15 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.54 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.6 HG12 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.22 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 73.42 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.31 109.599 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.739 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 75.31 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.693 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 64.5 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.6 ' HG2' HG12 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.41 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.73 HD21 HD13 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 63.55 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 70.13 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 74.12 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.45 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.32 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 73.41 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.685 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.32 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.23 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.35 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.795 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.45 110.625 -176.226 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.1 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.526 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.34 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.515 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.502 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.11 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.557 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.13 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.693 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 75.13 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 73.04 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.739 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 74.32 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.45 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.31 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 72.34 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 74.22 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 71.45 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.54 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.33 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.464 HG22 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.42 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 72.02 109.909 175.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.559 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.43 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.579 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.32 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 74.14 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 71.44 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.04 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.14 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.559 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 72.22 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.53 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.31 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.548 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 75.23 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 73.23 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.42 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.12 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.468 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.42 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.548 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.4 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.444 ' HE1' ' HB3' ' A' ' 67' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.13 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.46 ' HE2' ' HD2' ' A' ' 66' ' ' LYS . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.264 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.659 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.04 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.44 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 75.31 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.423 HD21 ' HA ' ' A' ' 72' ' ' ASN . 0.6 OUTLIER -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.51 110.549 -177.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.24 110.021 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.541 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.31 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.48 HG23 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.41 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.659 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 73.11 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.48 ' HG3' HG23 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.53 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.515 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.3 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.712 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.35 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 75.31 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.42 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 75.34 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.41 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.44 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 75.33 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.43 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 72.34 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 73.42 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 75.41 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.538 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.21 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.44 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.468 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 75.41 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.579 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.53 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.25 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 75.41 111.061 179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.73 HD13 HD21 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 74.2 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.23 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 71.3 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.11 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 72.43 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 74.14 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 70.53 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.31 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 75.01 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 71.22 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 72.22 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 71.54 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 75.04 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.538 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.42 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 72.02 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.57 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 74.22 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.34 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.637 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 64.41 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.57 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.41 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.423 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.22 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.508 ' CA ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 70.13 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 73.2 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 72.31 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.4 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.685 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.43 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.34 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.715 -0.476 . . . . 74.25 109.715 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -130.68 135.18 47.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.197 -0.456 . . . . 75.14 110.43 -177.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.83 111.19 2.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.878 -0.601 . . . . 74.22 110.565 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm -67.38 -20.73 65.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 75.15 111.138 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 73.03 110.257 177.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.539 ' HD2' ' HG2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 74.45 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 74.52 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.31 111.349 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.402 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 64.31 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.22 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 64.24 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.11 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.553 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.34 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 73.33 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.779 ' HG3' ' HB3' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.04 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.479 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.01 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.11 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 73.53 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.672 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 64.53 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.672 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.11 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.42 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 72.41 110.374 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.459 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.32 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.556 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 72.02 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.779 ' HB3' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.31 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.23 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 74.02 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.415 HD11 ' N ' ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.11 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 75.0 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.534 ' HA ' ' OE1' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 73.54 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.33 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.43 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 13.1 mm100 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.31 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 71.31 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.536 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 73.21 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 75.12 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.553 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 75.35 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.403 ' HB3' HD23 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.44 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.15 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 74.12 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.05 110.896 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.643 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 73.53 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 72.13 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.42 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.24 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.643 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.22 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 73.33 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 74.35 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.448 HG22 HG22 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.21 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.41 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 73.54 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.14 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.31 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.456 ' HB3' HG22 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 75.43 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.24 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 71.33 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 75.32 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.23 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.456 HG22 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.42 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.4 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.478 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.51 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 63.52 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 74.3 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.521 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.451 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.03 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.746 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.31 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.51 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.15 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 74.53 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.42 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 74.32 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 71.15 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.34 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.55 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.22 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 75.35 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.44 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.746 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 73.15 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.52 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.451 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 71.3 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.51 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.529 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 74.45 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.545 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.41 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.545 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 63.34 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.24 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 71.5 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.442 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.42 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.462 ' CD ' ' HZ2' ' A' ' 64' ' ' LYS . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.42 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.42 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 73.52 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 74.33 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 75.34 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.32 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.41 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 75.54 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.448 HG22 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.31 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.613 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.52 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.45 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.24 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 74.44 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 72.13 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.43 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG12 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.21 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.45 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.2 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.14 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.54 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.13 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.33 109.577 176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.54 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 64.21 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.625 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 73.15 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 71.33 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 74.32 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.625 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 71.11 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 74.23 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 72.13 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.534 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 74.11 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.24 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.44 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.15 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.459 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 53.25 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.446 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 62.44 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 109.917 -0.401 . . . . 71.13 109.917 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -106.07 121.0 43.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.374 -0.375 . . . . 74.31 111.615 -177.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 41.0 mt-10 -107.33 108.47 19.86 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.078 -0.712 . . . . 74.12 109.078 168.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt -76.44 -36.56 57.87 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.081 0.467 . . . . 74.53 110.077 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.51 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.44 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.01 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.13 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.489 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 71.43 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.12 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.24 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.24 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.52 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 74.42 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.494 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.24 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.494 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.44 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 73.43 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.499 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 74.32 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.33 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.499 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 75.32 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.981 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 73.51 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.22 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.11 109.409 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.567 HD12 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.14 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.472 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 72.3 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.13 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.687 HD11 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.35 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 72.32 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.581 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.23 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 74.43 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.425 ' H ' ' C ' ' A' ' 31' ' ' GLU . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.51 111.859 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 75.1 110.141 -176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.13 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 72.43 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.567 ' CE2' HD12 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.41 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 74.12 109.828 173.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.513 ' HB3' HD23 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 74.41 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.612 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 74.4 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 75.31 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.981 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.13 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.533 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 74.52 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.479 HD13 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 74.54 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.482 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 74.42 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.31 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.02 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.12 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 74.43 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.474 HG23 HG22 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.22 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.11 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.472 ' HH ' HG23 ' A' ' 76' ' ' ILE . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.54 109.285 175.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.675 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.55 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 73.03 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.22 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.31 112.194 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.01 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.1 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 74.4 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 72.42 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.533 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.23 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 71.31 112.358 -176.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 63.34 112.698 -179.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.493 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 73.54 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.465 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.4 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.681 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.24 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.672 ' HE2' ' HE2' ' A' ' 78' ' ' MET . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 74.1 110.9 -175.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 73.22 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 75.55 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.5 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.14 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 72.23 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.42 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.479 ' CA ' HD13 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.33 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 72.12 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.472 HG23 ' HH ' ' A' ' 52' ' ' TYR . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 71.23 109.252 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.489 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.24 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.681 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 72.44 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 74.22 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.493 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 75.53 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 75.01 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 75.34 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 74.21 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 73.23 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.43 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.43 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.12 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.4 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.463 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 64.14 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 75.34 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 75.34 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.675 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 74.43 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.421 ' HZ ' ' HE3' ' A' ' 78' ' ' MET . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.32 111.146 -177.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.24 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.474 HG22 HG23 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 71.32 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.44 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.35 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 74.24 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.31 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 71.33 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.51 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 75.13 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.23 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 74.31 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.41 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.618 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 64.41 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.463 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.03 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 61.34 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.503 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 73.45 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.24 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.618 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.32 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.14 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 75.43 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.687 ' HB3' HD11 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 75.33 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.442 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.04 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.21 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.11 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.53 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.476 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.03 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.31 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 121.013 0.435 . . . . 74.41 110.034 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -99.4 90.98 4.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.439 0.638 . . . . 75.42 109.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -89.0 176.0 7.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.206 -0.906 . . . . 60.54 110.999 -173.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.44 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? -70.34 -12.09 61.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.32 110.721 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.23 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.51 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.466 ' H ' HD23 ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.53 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.12 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.533 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 73.01 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.423 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 64.14 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.41 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.42 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.3 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.14 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.24 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.572 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.24 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.572 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 75.24 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 73.21 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.404 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 75.34 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.422 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 73.34 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.422 ' HB ' ' O ' ' A' ' 20' ' ' PRO . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.24 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 73.23 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.563 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.24 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 72.21 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 73.32 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.32 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 51.31 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 74.4 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.456 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.4 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.573 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 74.22 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.774 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 71.23 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.41 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.24 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.573 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 26.3 tp60 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.54 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.05 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.533 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 75.32 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.01 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.33 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.552 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.22 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.563 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.51 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.04 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 70.13 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 73.13 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.811 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 74.34 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.811 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 65.32 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.45 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.44 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.31 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 72.11 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.44 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.01 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.434 ' HB3' HG22 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 74.41 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.1 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.53 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.54 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.24 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.32 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.54 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.456 ' CD ' ' HZ1' ' A' ' 66' ' ' LYS . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.55 109.993 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.55 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 74.34 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.4 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.697 ' HD1' ' HE2' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.21 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.456 ' HZ1' ' CD ' ' A' ' 61' ' ' GLU . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 71.32 109.459 173.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.33 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.05 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.89 HD11 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 71.13 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 65.03 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 74.4 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.53 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.42 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 55.43 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.423 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.53 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.89 HG12 HD11 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 71.03 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 60.34 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.567 ' SD ' ' HE1' ' A' ' 80' ' ' MET . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.22 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.14 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.697 ' HE2' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.43 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 61.43 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.427 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 75.3 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.43 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.33 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.43 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 64.12 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.601 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 74.44 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 75.44 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.416 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.44 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.51 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.523 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.1 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 65.43 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.42 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.446 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.05 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.32 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 73.22 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.52 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 75.33 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.446 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.11 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 75.1 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.401 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 73.05 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 74.44 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.02 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.14 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.416 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 72.3 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.601 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 73.11 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 75.01 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.52 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.62 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.21 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 71.15 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.436 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.32 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.62 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 74.41 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 73.43 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 71.13 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.456 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.51 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.31 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 73.15 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 62.12 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.11 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.774 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 71.43 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 109.862 -0.421 . . . . 70.22 109.862 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -105.87 106.73 17.37 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.13 -0.322 . . . . 75.42 110.13 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -119.11 100.69 7.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.015 0.436 . . . . 72.4 112.167 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp -72.44 -19.3 61.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.622 -0.881 . . . . 73.41 108.622 171.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 72.31 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.41 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 74.23 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.34 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.651 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 71.53 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.42 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.33 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 65.15 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 61.42 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 73.13 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.481 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.44 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.783 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.34 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.783 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 74.52 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.01 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.408 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.34 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.14 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.51 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 62.02 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 72.41 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.4 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.481 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.05 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.483 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 75.24 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.24 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.31 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.547 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.14 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.516 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 72.33 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 73.14 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 73.5 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HD2' ' H ' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 73.24 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 73.22 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.34 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 71.15 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.547 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.24 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.483 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 60.23 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.57 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 73.11 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.488 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 75.43 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.42 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 71.41 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.53 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 74.32 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.24 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 71.5 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.13 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.24 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.23 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.5 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.21 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.52 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.32 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 74.24 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.689 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.34 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.14 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.421 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 74.0 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 74.23 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 71.43 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.34 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 65.35 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.32 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.54 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.403 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.11 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.403 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.34 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.02 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 75.44 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.506 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 74.54 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 73.31 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.24 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.527 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.3 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.21 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.51 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 62.15 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 75.02 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.31 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 75.42 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.641 ' HE2' ' SD ' ' A' ' 80' ' ' MET . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 71.34 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.13 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.641 ' SD ' ' HE2' ' A' ' 78' ' ' MET . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 65.2 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.436 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.42 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.436 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 65.25 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.414 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 73.42 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.57 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 26.4 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 75.42 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 87' ' ' ASP . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.13 110.556 174.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.33 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.57 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 74.0 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.03 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.404 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 75.14 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.406 HG22 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.45 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 75.12 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.689 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.23 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.35 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.52 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 75.22 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.51 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.53 ' HA ' HG21 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.12 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.51 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.14 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 100' ' ' ALA . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 65.12 111.397 174.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 72.4 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.424 ' H ' ' C ' ' A' ' 98' ' ' GLY . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 74.21 110.046 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.53 HG21 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 55.34 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.42 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.32 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.53 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.53 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.33 109.168 -177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.406 ' HB ' HG22 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 74.31 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.41 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.404 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 75.5 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.41 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 71.51 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.32 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.581 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 74.13 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 74.52 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.02 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 73.4 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.13 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 73.11 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.53 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 72.23 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.22 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 74.14 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.067 -0.346 . . . . 74.42 110.067 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -118.45 106.17 12.43 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.968 0.414 . . . . 75.35 110.408 175.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.503 ' OE2' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -93.13 164.94 13.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.813 -0.63 . . . . 72.41 109.333 174.249 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -66.65 -24.48 66.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.149 -0.22 . . . . 74.43 111.252 -176.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.45 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.52 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.503 ' HB2' ' OE2' ' A' ' 3' ' ' GLU . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.21 109.894 172.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 74.14 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.22 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.426 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 74.21 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.44 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 74.34 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.11 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.23 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.82 ' HZ1' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.42 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.559 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.34 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.43 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 72.13 110.015 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' A' ' 21' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 74.02 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 74.34 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.454 ' H ' ' C ' ' A' ' 19' ' ' VAL . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.05 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.763 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.45 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.573 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.31 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 71.21 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.66 HD12 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 72.04 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.82 ' HB2' ' HZ1' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.1 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.42 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 75.32 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 73.03 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 74.52 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.03 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.508 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 65.3 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.12 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.44 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.31 111.239 -176.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.433 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.32 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.02 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 74.13 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.494 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.32 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.12 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.428 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.24 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.763 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.12 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.01 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.405 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 73.3 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 71.45 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 75.11 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.13 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.2 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.52 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.43 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.11 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 70.34 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.531 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.42 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.04 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 4.0 t-20 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.53 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.45 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.44 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.422 ' HG3' HD11 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.22 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.55 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.33 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.14 109.592 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 74.11 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.53 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.56 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.2 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.24 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 73.31 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.15 110.339 -176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 74.34 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 75.41 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.32 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.43 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 75.1 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.01 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.34 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.12 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.53 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.459 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.15 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.45 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.54 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 75.12 112.074 -175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.12 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.466 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.52 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 75.02 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 73.03 112.447 -174.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.423 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 75.14 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.22 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.56 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.53 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.21 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 74.42 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 74.34 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.406 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 72.01 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.531 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 74.34 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 75.51 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 73.22 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.24 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 72.15 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.35 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 75.21 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.491 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.42 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 73.34 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 72.55 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 73.14 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.66 ' HB2' HD12 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.3 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.14 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.01 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 75.55 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 73.4 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 73.2 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.34 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.45 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.45 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.479 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.44 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 73.34 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 60.11 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 73.42 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 31' ' ' GLU . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.43 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 74.14 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 75.14 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.33 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.414 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 74.41 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 75.12 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 71.14 110.013 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -102.98 164.71 11.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.969 -0.559 . . . . 73.5 110.669 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.28 152.88 51.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.034 -0.53 . . . . 72.54 110.279 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt -70.64 -20.92 62.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.0 -0.546 . . . . 75.15 111.37 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.12 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.668 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.24 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.23 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 72.21 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.425 ' HB3' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.44 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 71.13 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.412 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.43 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.437 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.54 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 75.04 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.34 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.464 ' HE2' ' HB3' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 75.15 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.604 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 65.14 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.604 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.42 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 73.34 110.617 -179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 75.04 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 74.02 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 54.25 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.726 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.34 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.03 109.204 173.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.926 HD21 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.13 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.464 ' HB3' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 75.14 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 72.3 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.501 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.493 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.43 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 71.3 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.614 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 74.53 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.32 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.426 HE22 ' HB3' ' A' ' 81' ' ' GLU . 17.3 mm-40 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 73.23 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.3 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.501 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.41 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.22 108.415 172.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.437 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.15 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.451 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.2 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.726 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 73.5 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.41 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.519 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 75.12 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 74.03 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.654 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.54 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.424 ' C ' ' H ' ' A' ' 47' ' ' ASN . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.41 110.077 175.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 52.25 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 45' ' ' SER . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 74.33 110.277 174.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.02 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 75.41 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 73.03 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.34 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 75.42 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.463 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 72.41 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.35 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 74.55 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.55 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.22 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.33 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.15 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 75.12 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.43 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.11 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 73.21 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.45 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 73.31 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.415 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.44 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 72.32 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.3 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.571 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 73.02 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 75.1 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 73.33 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.654 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 75.44 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.453 ' N ' HD21 ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.13 107.121 167.534 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 62.54 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.42 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 73.05 110.222 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.4 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.571 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.45 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.22 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.668 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.5 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.426 ' HB3' HE22 ' A' ' 34' ' ' GLN . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.43 108.453 170.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 71.21 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 75.32 107.966 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 65.11 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.41 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.23 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.34 109.41 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.621 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.53 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.41 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.31 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.01 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.463 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.3 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 61.52 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.24 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.926 HD11 HD21 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.53 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 74.41 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.519 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 75.14 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 75.13 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.21 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 75.52 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 72.13 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.21 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.33 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.51 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.33 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 65.42 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.24 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.621 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 74.35 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 73.35 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.51 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.13 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 74.05 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.625 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.14 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 64.13 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.428 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 74.14 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 75.24 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.625 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 71.33 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.23 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.45 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.413 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.44 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.51 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.273 -0.269 . . . . 72.31 110.273 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 56.71 27.83 13.27 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.521 0.677 . . . . 75.21 111.108 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.41 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 6.7 pt-20 -90.05 33.53 0.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.229 -0.896 . . . . 71.22 110.321 -177.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm -58.52 -32.18 68.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 75.52 111.753 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.11 111.457 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.465 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 73.41 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 73.43 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 72.55 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.785 ' HB1' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 65.11 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.1 108.823 176.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.2 109.931 178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.34 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.439 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.21 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 72.04 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.647 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 74.02 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.493 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.24 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.647 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.21 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.461 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 62.0 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.973 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.21 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.973 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.45 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.1 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 74.21 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.3 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.461 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 74.42 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.14 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.23 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.54 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.32 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 72.32 110.574 -176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.54 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.495 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.23 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 73.32 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 65.41 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.718 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.42 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 74.34 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.22 110.077 -178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.515 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.55 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.608 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 74.43 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.464 ' HB3' HD23 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.33 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.35 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 73.32 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.42 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.45 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.556 HD11 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 73.1 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.34 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 71.23 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.34 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.41 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 74.03 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.1 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.23 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 75.14 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.478 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 74.24 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.415 ' HB3' HG21 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.42 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 64.52 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 72.13 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 75.52 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 73.44 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.415 HG21 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 73.41 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.23 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.23 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.11 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.505 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.31 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.21 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.465 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 73.34 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.21 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.04 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.55 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.43 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.52 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.8 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 74.24 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 75.34 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 73.44 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 71.03 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 73.44 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.55 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.24 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 72.01 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.515 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.33 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.785 ' HB2' ' HB1' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.4 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.1 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.718 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 72.43 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.42 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.05 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.21 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.11 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 71.13 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 74.14 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.15 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.505 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.22 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.566 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 63.14 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.2 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.3 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.478 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 74.44 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.11 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.35 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.51 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.43 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.43 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 73.35 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.939 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.1 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.11 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.15 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.422 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 73.44 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.2 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 73.01 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 73.33 109.339 -177.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.509 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.3 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.558 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.41 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.566 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 71.1 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.03 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.22 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.11 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.558 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.52 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 74.13 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.518 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 72.44 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 72.23 110.735 -179.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.495 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.31 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 71.42 111.725 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 72.24 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.54 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 62.21 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.12 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.139 -0.319 . . . . 74.51 110.139 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.15 90.89 8.0 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 73.51 109.455 172.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.455 ' CD ' ' HZ3' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -85.32 109.42 18.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.433 -0.803 . . . . 75.13 110.644 -174.113 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.1 -36.39 83.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.2 110.886 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HZ3' ' CD ' ' A' ' 3' ' ' GLU . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.24 110.671 -178.62 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.32 110.415 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 74.34 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 74.53 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.51 ' HB1' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.45 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 74.21 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.35 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.53 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.45 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.45 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.736 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 72.44 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.736 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 75.41 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.606 HG22 HG23 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 74.12 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 60.21 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.606 HG23 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.22 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.32 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 75.14 110.003 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.632 ' HB3' HE22 ' A' ' 40' ' ' GLN . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.11 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.474 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.42 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 74.3 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 74.2 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.429 ' N ' HD13 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 63.24 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.696 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 70.34 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.459 ' OE1' ' HG3' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 72.21 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.459 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 74.13 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.31 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.696 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.52 110.036 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.15 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.417 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.31 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.474 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.23 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.596 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 73.12 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.22 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.632 HE22 ' HB3' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.12 110.646 -178.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 72.33 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.475 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.21 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.52 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.23 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.13 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 75.12 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.51 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.52 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.23 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 73.45 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 65.55 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.41 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.775 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.11 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 74.32 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 72.55 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.05 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 61.41 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.452 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.44 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 72.22 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 73.44 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 73.4 109.715 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 73.24 113.26 -173.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.23 113.586 -175.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.991 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 75.13 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.598 ' HA ' ' HE3' ' A' ' 80' ' ' MET . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 73.43 109.458 -178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.24 109.65 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.437 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.41 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.22 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.15 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 75.2 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.766 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 74.22 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.42 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.23 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 63.21 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 74.42 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.33 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.51 ' OE1' ' HB1' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.33 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.54 ' SD ' ' HE2' ' A' ' 80' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.32 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 75.3 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.598 ' HE3' ' HA ' ' A' ' 65' ' ' TYR . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 72.02 110.875 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.33 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.587 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 65.12 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.991 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 71.53 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.32 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 74.35 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.24 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.486 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.31 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.03 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.488 ' HA2' HG22 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.4 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 75.42 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 73.33 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.775 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.13 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 75.44 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.33 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.1 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.451 ' O ' ' HB1' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.41 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.53 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 73.21 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 71.02 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 74.24 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 73.03 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.03 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 74.21 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.52 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 74.54 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 74.52 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.32 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.2 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.488 HG22 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.34 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.04 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.713 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 45.52 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.4 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.21 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.713 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 72.42 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.14 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 74.33 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.441 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 7.5 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 74.21 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 72.14 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.23 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 71.01 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.426 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.15 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 74.3 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.72 0.295 . . . . 74.11 110.3 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.9 pm0 -77.12 162.52 27.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.167 0.508 . . . . 74.51 111.007 179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.431 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -71.3 123.11 21.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.51 -0.768 . . . . 74.42 110.71 -174.875 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm -79.5 -37.56 36.43 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.33 112.593 -177.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 72.32 112.16 -170.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 75.43 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 61.51 110.5 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.41 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.33 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.31 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.57 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.43 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.01 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.34 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.12 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.43 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.681 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 72.04 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.44 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 64.41 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.453 HG21 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 74.14 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.43 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.453 ' H ' HG21 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 72.24 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 75.13 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.41 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.31 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.584 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 73.51 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.31 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 74.3 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.504 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 74.13 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.531 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 75.21 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.456 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 74.24 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.422 ' HB3' ' HG2' ' A' ' 117' ' ' GLN . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 70.21 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.32 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.477 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 9.4 mm100 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 74.51 112.188 -162.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.57 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 70.51 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.584 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.55 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 73.13 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.491 ' HB3' HD23 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.21 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.41 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 75.12 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 74.41 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.44 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 74.04 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.03 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 63.32 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.35 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.42 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 75.24 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.501 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 74.31 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.41 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.543 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.11 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.601 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.32 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.43 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 75.5 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.41 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.11 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 75.33 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 75.24 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 74.52 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.476 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 74.13 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.13 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.507 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 74.42 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.417 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.22 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.476 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 75.21 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 71.13 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 75.44 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.43 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.3 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.22 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 73.31 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.43 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.51 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.42 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.457 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 74.2 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 74.03 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 72.24 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 73.55 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.56 ' HE3' ' CE2' ' A' ' 91' ' ' TYR . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.12 111.65 -175.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.477 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.34 109.749 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.422 ' HA ' ' OE1' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 74.3 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.444 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.444 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 74.03 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.41 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.31 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.507 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.33 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.422 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.43 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 75.15 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 75.11 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.56 ' CE2' ' HE3' ' A' ' 80' ' ' MET . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.44 109.882 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.601 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.11 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.31 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.04 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.501 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 55.43 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 62.52 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.35 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 74.54 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 75.13 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 74.32 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.33 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.14 111.975 175.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 65.44 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.584 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.12 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 74.34 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.51 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.546 HG13 HG12 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.43 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 74.11 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 74.41 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.3 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.01 111.35 -176.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.546 HG12 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 75.11 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.02 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.33 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 74.41 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 73.14 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.531 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 72.4 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.41 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.21 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 75.14 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.45 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 74.12 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 110.206 -0.294 . . . . 75.2 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -73.5 135.31 44.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.449 -0.575 . . . . 70.12 109.449 175.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 6.9 tt0 -80.51 118.73 22.37 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.569 -0.741 . . . . 72.12 111.838 -172.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -77.62 -12.56 59.98 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.233 -0.439 . . . . 74.31 112.031 177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.546 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 74.55 111.202 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 73.13 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 73.44 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.52 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.23 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.418 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 72.42 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.23 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.32 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.456 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.02 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.01 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 72.04 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.67 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.12 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.67 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 62.23 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 72.43 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.464 HG12 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.44 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 74.51 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.464 ' O ' HG12 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 74.33 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.573 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 75.31 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 71.23 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 75.23 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.783 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 74.13 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 73.43 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 73.31 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 74.41 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.44 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.13 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.622 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.24 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.622 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.44 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.43 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.5 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 9.4 mm100 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 74.42 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 73.01 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 72.21 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.536 ' CZ ' HD22 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.54 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.403 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.41 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HB3' HD21 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 74.51 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.456 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.4 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 74.51 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.573 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 74.34 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.474 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.33 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 72.44 109.381 175.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 73.33 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.2 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.23 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.01 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.531 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 72.51 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 74.34 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 73.3 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.516 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 70.42 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.676 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 74.43 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 75.31 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.13 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 74.31 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 72.24 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.35 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.15 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.14 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.31 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.412 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.41 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.412 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 55.13 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.441 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.33 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.496 ' HB3' ' HE3' ' A' ' 67' ' ' MET . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 73.5 110.59 -178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 72.24 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.537 ' HE1' ' SD ' ' A' ' 78' ' ' MET . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.51 111.162 -175.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.43 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 74.43 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.51 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.13 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 74.53 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 74.35 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 61.23 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 74.3 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.02 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 75.25 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.537 ' SD ' ' HE1' ' A' ' 67' ' ' MET . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 74.52 109.32 177.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.23 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.513 ' HE2' ' HE3' ' A' ' 78' ' ' MET . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.1 110.766 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.31 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.409 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.31 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.24 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.535 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 74.43 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.535 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 74.05 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.456 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 73.42 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.441 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 54.14 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 75.33 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.44 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.31 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.22 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.676 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.01 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.516 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 74.23 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.21 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.469 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 74.12 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.531 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.14 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.61 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.41 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 73.4 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 75.21 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.61 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 75.15 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 72.14 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.3 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 74.54 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.783 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 72.42 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.41 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.41 109.112 -175.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 71.25 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.536 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 65.5 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.03 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 64.32 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.43 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.43 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.536 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 72.1 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.13 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.04 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 73.24 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.546 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.54 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.463 ' HZ3' ' HB3' ' A' ' 118' ' ' LYS . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.21 111.687 176.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.52 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 62.1 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.04 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.52 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 109.895 -0.409 . . . . 72.44 109.895 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -108.34 68.85 0.71 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.186 -0.461 . . . . 74.32 109.89 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.85 136.96 55.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.737 -0.665 . . . . 72.32 110.122 178.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -64.55 -21.61 66.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.688 0.28 . . . . 72.43 111.058 -174.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.54 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 72.21 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 72.32 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.31 110.396 174.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.473 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.51 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.526 HD23 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 73.43 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.32 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.11 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 75.34 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.03 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 74.14 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.533 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 75.22 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.533 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 65.41 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.4 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.759 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.34 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.759 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.52 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.14 111.087 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.787 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 74.33 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.34 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.22 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 74.42 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 74.11 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 74.12 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.451 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.51 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 74.13 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.53 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 73.0 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 73.31 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.425 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.34 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.59 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.45 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.566 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.13 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.473 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.12 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.538 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 72.31 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 74.42 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.542 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 73.24 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 74.41 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.32 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.787 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 74.42 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.571 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 72.22 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.2 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 72.41 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 65.2 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 73.51 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.21 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.04 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.412 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.43 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 63.12 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.541 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.64 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.43 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.12 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.55 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.44 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 75.43 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.11 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.15 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.419 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.33 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.14 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.33 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.799 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 74.42 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.11 111.029 -170.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.508 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.22 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.41 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 73.04 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 75.43 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.413 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 72.04 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.34 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.12 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 73.32 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 72.33 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.519 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 75.12 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.526 ' HG2' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.43 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 72.1 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 71.43 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.572 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.22 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 73.05 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.01 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.799 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 65.22 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 64.13 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.21 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.32 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.2 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 75.15 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.451 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.22 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 75.3 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.572 ' HE2' ' HE2' ' A' ' 80' ' ' MET . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.03 109.227 173.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.68 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 71.44 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.541 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.01 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.02 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.518 HD13 HD21 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 70.32 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.42 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.497 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.34 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.51 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.14 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 71.11 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 75.13 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.21 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.419 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.1 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.68 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.41 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.45 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 74.34 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.44 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 74.41 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.31 110.297 178.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.451 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 73.14 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 72.2 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.643 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.52 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 73.21 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.15 112.437 -175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.643 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 63.35 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.13 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 74.24 110.497 177.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 72.24 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 74.25 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.23 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.42 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.43 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.42 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.363 -0.606 . . . . 75.13 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -111.05 132.26 54.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.325 -0.398 . . . . 73.54 111.055 -173.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -78.27 102.78 7.82 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.833 -1.173 . . . . 74.4 107.833 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm -67.91 -32.09 72.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.423 -0.808 . . . . 72.3 112.815 -162.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 74.21 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.444 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 73.54 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 73.43 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.21 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.41 110.99 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.52 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 65.31 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.13 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 74.04 109.715 178.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.43 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 74.4 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.598 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 75.52 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.32 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 74.54 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 73.11 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.15 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.44 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.35 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.24 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 75.23 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD13 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 73.02 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.13 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.415 HG21 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.21 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.57 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.3 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 74.44 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 64.54 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 74.24 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.43 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.33 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 12.1 mm100 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.34 111.984 -169.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.55 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.57 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 75.33 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.425 ' CE2' HD22 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 74.11 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.44 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.487 ' HE3' HG22 ' A' ' 50' ' ' VAL . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 74.24 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 74.22 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.42 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.24 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.422 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.52 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.566 HD21 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 72.45 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.443 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 74.21 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 70.44 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 71.14 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.44 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.685 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 75.22 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.487 HG22 ' HE3' ' A' ' 39' ' ' MET . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.13 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.582 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 74.1 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.33 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 71.43 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 75.34 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.51 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.14 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.483 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 70.2 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.41 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.523 ' CD ' ' HZ2' ' A' ' 66' ' ' LYS . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 75.45 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.22 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.51 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.554 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.52 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.53 109.9 -175.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.53 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.4 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.13 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.41 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.35 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.54 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.21 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 74.31 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.566 ' CA ' HD21 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.3 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.53 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 75.53 109.125 172.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 74.41 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.625 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.24 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.444 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.55 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.489 ' SD ' ' HE1' ' A' ' 78' ' ' MET . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.51 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 73.34 110.699 178.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.488 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 71.32 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.839 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.33 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.53 109.735 178.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.839 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.22 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.34 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.576 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.23 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.53 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.489 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 73.01 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.582 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.33 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 74.23 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.467 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.41 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.581 HD13 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 75.14 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.685 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.01 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 72.01 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.44 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.52 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.23 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.24 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 65.02 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 10.2 p80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.45 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.474 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.15 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 74.31 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.409 HD12 ' HG ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 74.21 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.54 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.45 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.409 ' HG ' HD12 ' A' ' 106' ' ' LEU . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 71.33 110.287 177.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.576 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 75.24 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.15 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.4 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.41 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.619 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.22 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.35 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.41 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 72.41 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 71.24 110.699 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.619 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.42 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.04 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.41 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 72.4 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.23 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.499 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 72.42 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.42 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.778 0.323 . . . . 72.42 110.497 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -106.57 90.25 3.28 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.118 0.485 . . . . 74.14 110.051 175.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' OE2' ' HB3' ' A' ' 5' ' ' LYS . 9.4 pt-20 -77.1 155.39 32.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.933 -0.576 . . . . 63.35 109.699 175.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -61.28 -26.98 68.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.882 0.372 . . . . 74.14 110.469 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.513 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 75.34 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.41 109.124 172.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.517 HD13 ' H ' ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 73.24 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 75.51 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.35 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.427 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.31 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.472 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 75.55 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 72.54 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 73.11 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.41 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.528 ' HB2' HG21 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.33 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.593 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.42 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.593 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.11 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.528 HG21 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.23 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.538 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.4 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.538 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 74.3 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.464 ' HB ' ' HB1' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 73.25 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 74.43 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.44 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.423 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 73.24 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.496 HD23 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.14 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.41 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.55 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.54 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 75.51 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.41 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' C ' ' H ' ' A' ' 32' ' ' LYS . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.43 109.019 177.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.425 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 64.31 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 30' ' ' LEU . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 74.12 110.013 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 73.42 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.15 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.14 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.54 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.54 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.496 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.55 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.417 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 74.52 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.535 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 73.44 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 72.32 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.15 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.703 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.45 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.32 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.562 HD13 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.51 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.24 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 65.51 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.13 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.45 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.43 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 70.14 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.522 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 75.54 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.35 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 75.1 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.4 ' HB3' HG22 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 75.51 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 73.34 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 73.51 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 74.11 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 73.41 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG22 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 75.41 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.15 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.03 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 73.42 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 71.25 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.43 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.1 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.12 109.182 177.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.3 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . 0.409 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.41 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 74.24 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.41 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.5 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.562 ' HA2' HD13 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 50.23 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.41 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.535 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 72.32 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.01 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.65 ' HE1' ' HZ ' ' A' ' 93' ' ' PHE . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.13 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.456 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.31 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.491 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.24 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.52 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.02 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 71.33 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 73.45 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 74.22 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.13 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.494 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.51 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.32 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.501 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.2 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.2 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.54 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.466 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.43 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.65 ' HZ ' ' HE1' ' A' ' 78' ' ' MET . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.34 110.508 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.522 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.52 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.12 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.24 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.44 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 74.22 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.12 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.464 ' HB1' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 72.34 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.01 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.23 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.35 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.15 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.34 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 73.32 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 74.5 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.52 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 65.22 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.501 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 74.13 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.1 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.663 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.51 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.411 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 71.45 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.43 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.663 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 75.25 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.411 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 74.43 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.34 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.601 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.55 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.22 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 75.32 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 71.24 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 74.43 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.43 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.898 0.38 . . . . 74.22 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -99.35 148.24 24.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.081 -0.508 . . . . 72.52 110.275 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -62.67 109.03 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.222 -0.444 . . . . 74.43 111.13 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -62.16 -19.16 62.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 75.32 110.605 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 74.54 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.43 ' O ' ' HD2' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 75.22 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 74.33 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.456 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 72.12 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.04 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.44 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.24 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.43 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.418 ' HA ' ' HH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 72.31 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 72.11 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.492 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.43 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 73.02 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.726 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 75.51 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 73.45 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.4 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.4 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.22 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 71.34 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 74.54 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.15 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.568 HD23 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.33 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.54 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.11 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.534 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.23 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 72.53 110.384 -175.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 72.05 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.805 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.35 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 75.35 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.4 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.846 ' HA ' HE21 ' A' ' 34' ' ' GLN . 0.0 OUTLIER -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 71.35 110.292 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 75.32 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.534 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.44 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 75.42 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.418 ' HH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 74.35 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.563 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 22' ' ' LYS . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.44 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.11 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.12 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.54 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.41 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 72.53 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.44 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 72.12 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 45.23 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HE2' ' HB2' ' A' ' 49' ' ' LYS . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 74.42 110.108 -176.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.579 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 64.05 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.34 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 73.54 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.24 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.478 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 75.34 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.22 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 75.4 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 74.42 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.23 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.23 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.15 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 73.35 110.49 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.21 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.14 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.563 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 74.31 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 75.31 111.26 -176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 74.41 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.3 111.479 -169.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.474 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.22 109.702 177.102 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 73.34 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.44 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.53 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 75.23 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.31 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 65.11 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 75.55 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 75.22 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.474 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.55 110.614 176.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.533 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.03 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.04 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.447 ' SD ' ' HE1' ' A' ' 78' ' ' MET . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.54 112.598 -172.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.563 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.31 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 75.32 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 75.12 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.474 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.15 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.2 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.474 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 72.24 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.54 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.45 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.546 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.21 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 74.52 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.31 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 74.35 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.494 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 65.43 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.505 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.15 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.579 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.44 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.15 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.34 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.15 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.627 ' HZ2' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 74.42 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 63.04 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.23 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.13 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 73.55 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.23 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.32 108.968 -178.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.11 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.541 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 74.2 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.546 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.54 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.33 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.41 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 74.35 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.541 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 71.31 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.32 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.2 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 74.32 110.513 177.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.35 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HE3' ' HB3' ' A' ' 118' ' ' LYS . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.4 111.489 -179.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.32 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 74.11 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.805 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 75.02 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 71.43 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.706 -0.479 . . . . 73.22 109.706 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -122.63 138.11 54.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.449 -0.341 . . . . 75.52 110.131 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.557 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 80.1 mt-10 -81.45 89.56 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.901 0.381 . . . . 75.21 110.09 177.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt -63.09 -30.05 71.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 73.03 110.485 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.44 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 71.12 111.328 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.2 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.34 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.549 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.24 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 74.12 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 70.21 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.3 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.42 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.14 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.41 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.695 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.2 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.695 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.31 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 72.24 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 75.42 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.42 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.411 HG23 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 74.34 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 75.4 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' HG23 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.23 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 74.21 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.698 HD22 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.34 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 71.55 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 74.54 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 73.15 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 72.41 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.53 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.643 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.42 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.643 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.01 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 70.22 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.442 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.3 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 74.24 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 74.35 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.698 ' CZ ' HD22 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.32 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.53 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 73.34 110.21 177.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.02 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.35 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.32 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.42 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 74.35 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 70.1 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.43 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.03 109.169 172.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.662 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.31 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 73.41 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.436 HG23 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 73.23 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 70.31 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.31 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.616 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.04 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.21 109.268 173.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 t-20 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.43 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.51 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 73.22 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.02 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 75.33 112.126 -173.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.02 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.51 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.41 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.2 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 74.01 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.695 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 75.21 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.523 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.15 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.567 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.44 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.539 ' HB3' ' HE2' ' A' ' 78' ' ' MET . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 75.41 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.487 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.33 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.24 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.32 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 71' ' ' ARG . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 74.42 109.726 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.41 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.45 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.33 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 73.21 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 63.23 110.001 -179.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.487 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.52 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 74.14 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.442 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.23 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 73.44 111.74 -178.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.44 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.515 ' O ' ' HD2' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.51 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.413 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.52 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.413 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 26.9 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.12 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.11 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.44 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.695 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.5 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.518 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.11 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.15 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.01 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.616 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.22 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 74.2 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.2 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.15 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.662 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 75.21 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.435 ' HA ' ' HA ' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 74.24 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 64.42 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.42 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.14 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.34 111.296 177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.22 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.43 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 60.23 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 64.22 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 73.52 108.849 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.44 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.5 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.3 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.518 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 75.42 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 44.53 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.492 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.33 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 71.43 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.03 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.507 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 75.44 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.45 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 75.34 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.507 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.33 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.32 111.079 176.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 71.44 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 61.22 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.49 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 74.31 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 75.12 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.874 0.369 . . . . 75.03 110.46 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -103.72 119.37 38.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.232 -0.44 . . . . 65.32 109.983 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.583 ' HB3' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -91.38 111.66 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.199 -0.667 . . . . 74.13 109.199 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm -69.32 -40.93 77.34 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.614 0.598 . . . . 75.34 112.614 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 74.42 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.583 ' HB2' ' HB3' ' A' ' 3' ' ' GLU . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 73.13 111.353 -178.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.2 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.43 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 73.51 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 75.42 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.04 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 74.31 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.523 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.24 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.32 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.702 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 75.43 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 74.45 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.656 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.13 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 74.2 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.435 HG21 ' HD2' ' A' ' 20' ' ' PRO . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 75.22 109.741 -176.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.435 ' HD2' HG21 ' A' ' 19' ' ' VAL . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 64.1 113.128 177.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 72.12 109.203 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.14 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 74.2 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.702 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.2 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.66 HD21 HD13 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 73.14 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.31 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 75.45 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.477 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 74.43 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 74.12 110.898 -175.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.24 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.02 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 73.52 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 51.14 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.689 ' HA ' HE21 ' A' ' 34' ' ' GLN . 0.0 OUTLIER -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 75.31 110.292 178.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.51 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.477 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.32 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.504 ' CZ ' HD23 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 74.0 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.13 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.52 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.549 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.22 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.31 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.483 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 75.44 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.483 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 74.02 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 73.55 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 74.22 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 74.3 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.35 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 72.03 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 74.33 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.14 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.435 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 71.11 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.583 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 72.11 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.794 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 75.13 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.444 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 73.02 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.22 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.34 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 74.11 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.583 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.34 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.444 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.41 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 71.22 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 61.15 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.43 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.21 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.535 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.23 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.04 109.414 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.14 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.45 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 74.5 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 73.31 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.14 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.84 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 74.15 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 74.33 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 74.05 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 74.11 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 74.51 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.479 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 73.13 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 74.22 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.507 ' SD ' ' HE3' ' A' ' 80' ' ' MET . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 62.23 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.32 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.507 ' HE3' ' SD ' ' A' ' 78' ' ' MET . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.21 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.535 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 54.54 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.3 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.22 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 71.53 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.21 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.24 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.31 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.421 ' CD ' ' HZ3' ' A' ' 64' ' ' LYS . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.2 109.54 177.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.43 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.43 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 75.12 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.794 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 75.41 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.31 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.35 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.66 HD13 HD21 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.1 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.12 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.556 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.43 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.04 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.436 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.34 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.556 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.33 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.33 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.21 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 71.53 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.32 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 65.12 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 74.13 108.756 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.452 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.41 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 64.21 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.14 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 74.44 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.552 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.2 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.21 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.572 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.01 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.43 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 70.45 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.31 110.023 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.572 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 0.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.41 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 63.52 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.41 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 62.02 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.34 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.12 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.957 0.408 . . . . 71.01 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -124.88 75.26 1.42 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.702 -0.481 . . . . 71.23 109.702 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -80.94 155.79 26.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.681 -0.691 . . . . 73.41 111.452 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -62.74 -23.67 67.3 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.867 -0.606 . . . . 71.43 112.004 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.567 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 73.24 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 75.12 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 73.24 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 74.22 110.637 177.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.688 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 70.04 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.01 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.33 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.11 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 73.41 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 73.1 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 74.15 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.12 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.42 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.13 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.946 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.42 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.946 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 71.1 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.667 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 74.34 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.742 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 60.33 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.1 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.1 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.503 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.14 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 70.35 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.24 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.632 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 74.22 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.513 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 74.04 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.45 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.905 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 75.24 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.31 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 64.33 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.6 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.51 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.41 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.688 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.51 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 73.41 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.55 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.432 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 72.24 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 74.31 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 75.24 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.742 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 73.22 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.454 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 65.13 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 75.23 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.53 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.41 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.52 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.625 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 65.04 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.15 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.52 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.31 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.533 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 70.23 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.626 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 74.42 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 72.14 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.33 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 73.45 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 73.01 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.42 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 73.15 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.33 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.13 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.11 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 51.34 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.751 ' HG2' HD23 ' A' ' 83' ' ' LEU . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 75.4 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 74.42 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 72.52 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.33 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 73.1 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.43 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.22 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 75.3 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 71.32 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.13 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 45.24 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 73.14 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.432 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 74.55 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 61.51 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.61 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.3 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.567 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 72.12 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.14 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.439 ' C ' HD21 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 74.32 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.751 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 75.21 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.03 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.01 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.04 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.734 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.31 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.419 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.22 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.551 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 70.11 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 73.04 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.419 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 72.33 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.626 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 75.04 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.533 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.2 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.13 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.446 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.12 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.625 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 75.23 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.637 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.34 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.22 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.44 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.21 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.446 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.24 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.503 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.12 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 52.24 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 74.22 108.783 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.43 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.558 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 65.42 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.551 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 63.41 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.02 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.51 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.34 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.404 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 73.21 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.558 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 74.32 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 74.13 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 73.31 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 72.22 110.822 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.905 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.03 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.54 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 73.14 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.44 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.517 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 75.45 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.31 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.982 0.42 . . . . 64.35 111.504 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -88.27 121.08 30.25 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.154 -0.684 . . . . 71.24 109.154 172.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.42 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 1.1 tm-20 -127.12 137.1 52.92 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.105 -0.498 . . . . 75.54 109.746 -172.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt -66.7 -37.14 84.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.518 0.562 . . . . 74.11 112.518 -169.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.42 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.21 110.864 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 75.12 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.21 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.23 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.4 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.34 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 64.23 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.54 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.45 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.14 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 74.21 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.467 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.35 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.467 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.34 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.13 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.772 HG23 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 74.11 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.53 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.51 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.424 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.42 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.675 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.43 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.772 ' HB2' HG23 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 54.32 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.465 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 74.54 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.431 ' N ' HD11 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.24 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 72.45 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 74.24 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.588 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 73.53 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 74.32 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.648 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.45 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.648 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 71.43 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 74.03 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 74.12 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.22 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.512 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.03 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 75.03 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.35 111.203 -178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 72.5 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.53 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.21 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.23 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.534 ' HB2' ' HZ1' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.23 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.51 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.32 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.13 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 62.51 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.12 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.34 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 64.55 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.11 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . 0.446 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.14 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.537 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 75.14 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.582 ' HB2' HD11 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 74.44 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 74.32 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' HA ' HG22 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 74.34 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.32 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.582 HD11 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 75.03 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.22 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.24 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.436 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.33 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . 0.436 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.15 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.1 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.434 ' HD1' ' SD ' ' A' ' 78' ' ' MET . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 73.55 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.4 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 71.15 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 75.31 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.02 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.12 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.01 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.52 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 71.24 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.425 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.1 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.451 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.43 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.41 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.595 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 71.22 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 60.03 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 74.45 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 75.2 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.14 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.418 HD11 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 75.53 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.14 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 74.31 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 75.52 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 71.34 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 64' ' ' LYS . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 72.32 107.502 169.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.57 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.32 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 70.05 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.44 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.11 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.625 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.24 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.48 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 74.23 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.33 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 74.25 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.42 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.675 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.3 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 75.4 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 63.53 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 75.31 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 74.23 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.04 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 75.15 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.625 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.34 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 74.21 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.23 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.419 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 75.44 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.471 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.53 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.57 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 73.0 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.22 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.627 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.42 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.11 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.471 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.11 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 75.01 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 73.34 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 74.21 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.535 HE21 ' N ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 64.21 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 74.22 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.473 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.42 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.588 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 73.25 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.487 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 71.25 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.32 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.115 -0.328 . . . . 72.42 110.115 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.72 122.27 32.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.177 -0.465 . . . . 74.14 110.437 178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' OE1' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -110.27 175.34 5.47 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.759 -0.655 . . . . 63.35 109.788 176.722 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -64.78 -29.9 70.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.963 0.411 . . . . 74.14 110.719 -177.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 75.34 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.408 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.41 110.252 176.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 73.24 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 75.51 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.35 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.631 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.31 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 75.55 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 72.54 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.405 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 73.11 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.41 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.33 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.408 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.42 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.408 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.11 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.23 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 21' ' ' THR . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.4 110.144 173.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 74.3 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 19' ' ' VAL . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 73.25 108.508 171.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 74.43 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.44 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 73.24 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.61 HD23 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.14 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.484 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.41 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.55 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.48 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 75.51 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.428 HD11 ' N ' ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.41 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.43 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 64.31 112.113 -174.02 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 74.12 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 73.42 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.423 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.15 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.423 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.14 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.48 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.54 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.61 ' HZ ' HD23 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.55 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.484 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 74.52 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.826 ' HE3' HG22 ' A' ' 50' ' ' VAL . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 73.44 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 72.32 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.47 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.15 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.459 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.45 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.412 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.32 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.514 HD11 ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.51 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.453 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.24 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 65.51 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.13 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.562 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.45 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.43 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.826 HG22 ' HE3' ' A' ' 39' ' ' MET . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 70.14 109.869 174.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 75.54 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.35 108.814 173.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.452 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 75.1 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 75.51 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 73.34 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.445 ' HA ' HG21 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 73.51 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 74.11 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 73.41 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 75.41 111.029 -176.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.15 110.319 -176.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.03 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 73.42 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.495 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 71.25 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.712 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.43 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.1 109.582 171.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.12 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.3 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.41 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 74.24 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.41 110.991 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.5 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 50.23 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.41 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.472 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 72.32 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.01 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.46 ' HE2' ' CG ' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.13 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.31 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.423 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.24 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.456 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.52 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.02 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 71.33 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 73.45 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.413 ' C ' ' H ' ' A' ' 87' ' ' ASP . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 74.22 109.662 173.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.13 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.495 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.51 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.32 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.495 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.2 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.2 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.712 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.54 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.452 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.43 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.47 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.34 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.52 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.12 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.562 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.24 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.508 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.44 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 74.22 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.12 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 72.34 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.01 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.23 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.35 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.15 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 72.34 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 73.32 110.669 -176.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 0.449 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 74.5 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 65.22 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . 0.495 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 74.13 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.1 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.624 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.51 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 71.45 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.49 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.43 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 75.25 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 74.43 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.405 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.34 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.55 111.765 -176.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.22 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 75.32 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.408 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 71.24 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.43 110.289 -177.942 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.511 -0.551 . . . . 61.399999999999999 109.511 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HA ' HD23 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 73.549999999999997 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 65.349999999999994 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.010000000000005 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 43.43 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 52.229999999999997 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.499 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 71.540000000000006 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.319999999999993 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.239999999999995 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 50.25 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.709 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.439999999999998 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.709 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.149999999999999 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.329999999999998 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.634 HG11 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.219999999999999 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 72.319999999999993 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.310000000000002 109.599 178.088 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 64.129999999999995 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.702 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 62.030000000000001 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.634 ' HG2' HG11 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.409999999999997 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.705 HD23 HD11 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 43.130000000000003 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 44.119999999999997 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 73.109999999999999 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.450000000000003 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.319999999999993 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.821 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 70.299999999999997 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.705 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.049999999999997 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.350000000000001 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.821 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 21.3 mm-40 -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.450000000000003 110.625 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.099999999999994 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.565 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.340000000000003 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 11' ' ' SER . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.109999999999999 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.58 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.129999999999995 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.702 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 71.519999999999996 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 62.340000000000003 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 65.109999999999999 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.450000000000003 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.310000000000002 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 55.439999999999998 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 71.209999999999994 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 70.400000000000006 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.540000000000006 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.329999999999998 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.458 HG21 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.409999999999997 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.408 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 63.549999999999997 109.909 175.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.567 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.430000000000007 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.319999999999993 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 72.239999999999995 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 70.299999999999997 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.040000000000006 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.140000000000001 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 64.329999999999998 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.530000000000001 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.310000000000002 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.561 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 74.430000000000007 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 72.439999999999998 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.420000000000002 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.641 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.120000000000005 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.420000000000002 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.561 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.400000000000006 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.494 ' HB2' ' HE2' ' A' ' 78' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.129999999999995 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.264 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.671 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.040000000000006 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.439999999999998 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 72.310000000000002 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.510000000000005 110.549 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.240000000000002 110.021 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.555 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.310000000000002 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.409999999999997 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.671 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 53.210000000000001 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.502 ' HG3' HG22 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.530000000000001 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.534 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.299999999999997 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.734 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.349999999999994 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 73.349999999999994 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.420000000000002 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 71.120000000000005 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.641 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.409999999999997 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.475 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 71.310000000000002 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.430000000000007 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 44.340000000000003 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 52.140000000000001 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 64.230000000000004 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.542 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.209999999999994 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.439999999999998 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.469 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 72.430000000000007 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.587 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.530000000000001 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.239999999999995 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.408 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 74.530000000000001 111.061 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.705 HD11 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 64.010000000000005 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.230000000000004 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 60.329999999999998 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.109999999999999 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 71.030000000000001 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 63.039999999999999 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 62.32 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.310000000000002 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 61.420000000000002 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 64.439999999999998 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.422 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 71.239999999999995 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 52.219999999999999 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 72.109999999999999 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.542 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.420000000000002 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 71.349999999999994 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 73.239999999999995 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.656 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 63.0 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.030000000000001 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.428 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.219999999999999 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.514 HE21 ' CA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 55.43 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 72.120000000000005 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 62.210000000000001 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.400000000000006 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.705 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.430000000000007 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.340000000000003 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.446 0.165 . . . . 75.150000000000006 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 52.229999999999997 110.257 177.409 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.547 HH11 ' HB2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 73.329999999999998 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 64.349999999999994 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.310000000000002 111.349 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.415 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 44.140000000000001 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 63.25 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.109999999999999 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.563 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.340000000000003 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 72.310000000000002 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.815 ' HG3' ' HB2' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.040000000000006 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.45 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.010000000000005 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.109999999999999 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 61.140000000000001 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.687 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 53.030000000000001 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.687 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.109999999999999 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.049999999999997 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 42' ' ' GLU . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.439999999999998 110.374 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.319999999999993 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 60.439999999999998 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.815 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.310000000000002 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.230000000000004 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.556 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 73.510000000000005 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.109999999999999 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 53.340000000000003 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 65.140000000000001 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.329999999999998 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.140000000000001 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 80.9 mm-40 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.310000000000002 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 53.32 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.556 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 71.530000000000001 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 72.209999999999994 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.563 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 64.200000000000003 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HB3' HD22 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.409999999999997 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.150000000000006 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 60.100000000000001 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.049999999999997 110.896 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.669 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 62.109999999999999 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 44.039999999999999 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.420000000000002 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.239999999999995 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.669 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.219999999999999 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 51.149999999999999 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.632 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 71.409999999999997 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.47 HG22 HG23 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.209999999999994 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.422 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 71.299999999999997 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.099999999999994 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.310000000000002 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HB3' HG21 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 74.400000000000006 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.4 t30 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.240000000000002 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 64.420000000000002 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 70.319999999999993 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.230000000000004 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.420000000000002 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.400000000000006 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.487 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.510000000000005 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 33.210000000000001 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 65.129999999999995 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.030000000000001 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.200000000000003 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.510000000000005 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.150000000000006 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 71.430000000000007 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.420000000000002 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 52.140000000000001 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 65.439999999999998 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.549999999999997 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.219999999999999 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 72.140000000000001 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.439999999999998 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.763 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 65.209999999999994 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.519999999999996 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 70.239999999999995 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.510000000000005 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 65.219999999999999 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.558 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.409999999999997 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.558 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 62.299999999999997 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.239999999999995 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 63.340000000000003 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.45 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.209999999999994 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' LEU . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.420000000000002 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.420000000000002 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 55.409999999999997 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 71.409999999999997 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 63.32 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.120000000000005 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.422 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 50.100000000000001 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.47 HG23 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.632 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.519999999999996 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.239999999999995 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 60.049999999999997 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 63.039999999999999 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.430000000000007 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG11 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.209999999999994 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.450000000000003 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.200000000000003 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.140000000000001 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.540000000000006 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.129999999999995 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.329999999999998 109.577 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.540000000000006 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 51.43 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 30.129999999999999 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 65.129999999999995 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 73.0 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 64.099999999999994 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 61.520000000000003 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 62.020000000000003 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 73.409999999999997 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.239999999999995 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.439999999999998 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.150000000000006 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.477 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 41.520000000000003 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 61.100000000000001 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 121.081 0.467 . . . . 62.520000000000003 110.077 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.510000000000005 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.439999999999998 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.010000000000005 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.109999999999999 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.47 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.119999999999997 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.239999999999995 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.239999999999995 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.519999999999996 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 64.439999999999998 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.517 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.239999999999995 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.439999999999998 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 64.430000000000007 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 61.229999999999997 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.329999999999998 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.552 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 70.430000000000007 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.984 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 54.43 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.209999999999994 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 17' ' ' PRO . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.109999999999999 109.409 -178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.47 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 71.430000000000007 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.129999999999995 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.349999999999994 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 63.030000000000001 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.229999999999997 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.592 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 60.299999999999997 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.510000000000005 111.859 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 81' ' ' GLU . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 44.240000000000002 110.141 -176.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 64.409999999999997 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.409999999999997 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 72.200000000000003 109.828 173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.566 ' HB3' HD22 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 71.25 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 62.509999999999998 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 74.040000000000006 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.984 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.129999999999995 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 63.119999999999997 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.493 HD11 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 64.25 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 72.319999999999993 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.310000000000002 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.019999999999996 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.120000000000005 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.474 HG22 HG23 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.219999999999999 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.109999999999999 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.540000000000006 109.285 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.549999999999997 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 64.120000000000005 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.219999999999999 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.403 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.310000000000002 112.194 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.010000000000005 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.099999999999994 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 54.409999999999997 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 65.420000000000002 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.230000000000004 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 63.219999999999999 112.358 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 60.0 112.698 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 61.439999999999998 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.485 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.400000000000006 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.239999999999995 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 73.129999999999995 110.9 -175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 64.400000000000006 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 64.120000000000005 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.229999999999997 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.140000000000001 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 53.539999999999999 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.420000000000002 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.493 ' CA ' HD11 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.329999999999998 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 70.140000000000001 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 64.150000000000006 109.252 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.47 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.239999999999995 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.702 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 63.310000000000002 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 74.340000000000003 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 70.200000000000003 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.516 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 73.549999999999997 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 64.150000000000006 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 71.519999999999996 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.430000000000007 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.120000000000005 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.400000000000006 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.465 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 63.240000000000002 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.55 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 71.129999999999995 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 71.400000000000006 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.685 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 54.109999999999999 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.319999999999993 111.146 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.239999999999995 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.474 HG23 HG22 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 54.520000000000003 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.439999999999998 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.350000000000001 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 73.209999999999994 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.310000000000002 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 33.109999999999999 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.510000000000005 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 40.439999999999998 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 72.430000000000007 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.409999999999997 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.636 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 54.530000000000001 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.465 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.030000000000001 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 51.450000000000003 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 72.120000000000005 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.239999999999995 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.636 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.319999999999993 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.140000000000001 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 71.510000000000005 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.704 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 74.0 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.209999999999994 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.109999999999999 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.530000000000001 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.030000000000001 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.310000000000002 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.035 0.445 . . . . 74.319999999999993 110.721 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.230000000000004 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.310000000000002 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.507 HD22 ' H ' ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.120000000000005 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.120000000000005 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 51.229999999999997 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 62.039999999999999 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.420000000000002 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.299999999999997 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.140000000000001 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.239999999999995 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.584 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.239999999999995 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 74.530000000000001 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 63.219999999999999 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.412 HG22 HG22 ' A' ' 21' ' ' THR . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 71.129999999999995 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.434 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 70.430000000000007 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 23' ' ' SER . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.239999999999995 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 54.409999999999997 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.239999999999995 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 71.25 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 72.129999999999995 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.319999999999993 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 35.020000000000003 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 61.119999999999997 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.48 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.400000000000006 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.593 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 72.109999999999999 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.806 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 54.140000000000001 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.109999999999999 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.239999999999995 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.593 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 5.9 tp-100 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.540000000000006 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.049999999999997 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 74.219999999999999 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.531 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.010000000000005 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.329999999999998 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.566 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.219999999999999 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.571 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.510000000000005 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.040000000000006 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 63.140000000000001 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 70.200000000000003 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.806 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 62.119999999999997 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.806 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 43.340000000000003 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.310000000000002 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.439999999999998 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.310000000000002 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 52.350000000000001 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.439999999999998 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.010000000000005 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 51.310000000000002 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HB3' HG23 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 64.140000000000001 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.1 t30 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.099999999999994 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.530000000000001 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.409999999999997 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.240000000000002 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.319999999999993 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.540000000000006 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.549999999999997 109.993 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.549999999999997 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 73.129999999999995 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.400000000000006 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.525 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.209999999999994 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 70.030000000000001 109.459 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.329999999999998 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.049999999999997 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.916 HD13 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 65.340000000000003 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 55.240000000000002 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 71.230000000000004 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.230000000000004 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.420000000000002 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 54.32 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.441 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.530000000000001 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.916 HG12 HD13 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 61.329999999999998 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 54.009999999999998 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.140000000000001 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.525 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.430000000000007 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 53.299999999999997 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 73.540000000000006 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.430000000000007 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.219999999999999 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.430000000000007 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 63.020000000000003 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.606 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 72.430000000000007 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 41.310000000000002 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.439999999999998 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.510000000000005 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.529 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.099999999999994 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 55.299999999999997 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.420000000000002 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.049999999999997 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.319999999999993 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 54.409999999999997 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.219999999999999 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 61.020000000000003 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.109999999999999 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 31.239999999999998 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 70.129999999999995 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 71.310000000000002 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.019999999999996 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.441 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.140000000000001 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 71.310000000000002 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 65.439999999999998 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 72.450000000000003 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.519999999999996 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.209999999999994 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 65.5 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.486 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.319999999999993 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 63.200000000000003 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 70.5 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 70.439999999999998 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.48 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.0 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.310000000000002 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.557 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 63.240000000000002 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 60.25 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.109999999999999 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.806 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 63.32 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp . . . . . 0 C--O 1.231 0.098 0 N-CA-C 108.622 -0.881 . . . . 73.409999999999997 108.622 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 70.010000000000005 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.679 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.409999999999997 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 72.239999999999995 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.340000000000003 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 63.43 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.427 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.040000000000006 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 62.140000000000001 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 51.450000000000003 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 64.510000000000005 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.476 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.239999999999995 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.788 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.340000000000003 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.788 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 71.109999999999999 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.010000000000005 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.140000000000001 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 54.299999999999997 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.786 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 44.210000000000001 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.399999999999999 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.476 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.049999999999997 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 65.109999999999999 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.219999999999999 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.310000000000002 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.537 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 63.32 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 62.509999999999998 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 71.430000000000007 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.702 ' H ' ' HD2' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 65.299999999999997 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 34.219999999999999 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.340000000000003 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 64.310000000000002 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.55 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.239999999999995 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 50.140000000000001 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 64.120000000000005 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.499 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 73.299999999999997 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.532 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.420000000000002 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 64.430000000000007 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.786 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.546 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 61.149999999999999 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.239999999999995 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 53.149999999999999 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.129999999999995 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.109999999999999 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.230000000000004 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.25 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.209999999999994 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.535 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.319999999999993 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 71.239999999999995 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.340000000000003 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.140000000000001 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 72.540000000000006 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 71.230000000000004 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 64.340000000000003 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.340000000000003 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 53.409999999999997 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.319999999999993 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.540000000000006 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.109999999999999 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.340000000000003 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.434 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.019999999999996 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 73.519999999999996 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.491 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 64.040000000000006 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 71.409999999999997 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.239999999999995 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.299999999999997 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.546 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.209999999999994 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.510000000000005 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 52.530000000000001 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 71.239999999999995 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 74.120000000000005 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.491 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 70.0 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.129999999999995 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.472 ' O ' HG12 ' A' ' 35' ' ' VAL . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 63.299999999999997 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 64.439999999999998 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 71.329999999999998 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.584 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 78.7 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 64.150000000000006 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.129999999999995 110.556 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.329999999999998 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 64.209999999999994 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.030000000000001 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.416 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 42.329999999999998 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.450000000000003 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 61.030000000000001 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.698 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.230000000000004 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.349999999999994 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.535 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 72.239999999999995 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.510000000000005 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.598 ' HA ' HG22 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.120000000000005 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.140000000000001 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 43.530000000000001 111.397 174.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 71.219999999999999 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 73.430000000000007 110.046 176.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 54.009999999999998 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.420000000000002 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.319999999999993 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.530000000000001 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.530000000000001 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.329999999999998 109.168 -177.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.427 ' HB ' HG23 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 54.399999999999999 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.409999999999997 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.416 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 74.510000000000005 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.409999999999997 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 63.43 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.319999999999993 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 71.439999999999998 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 73.109999999999999 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.019999999999996 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 72.019999999999996 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.129999999999995 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 72.420000000000002 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.530000000000001 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 51.149999999999999 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.219999999999999 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 72.209999999999994 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.519 0.199 . . . . 74.430000000000007 111.252 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.519999999999996 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.209999999999994 109.894 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 62.140000000000001 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 72.140000000000001 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.439999999999998 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 61.0 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.109999999999999 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.230000000000004 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.420000000000002 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.569 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.340000000000003 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.430000000000007 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 19' ' ' VAL . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 63.009999999999998 110.015 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.459 ' N ' HG22 ' A' ' 18' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 72.230000000000004 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 73.530000000000001 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.437 HG22 ' OE1' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.049999999999997 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.450000000000003 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.579 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.310000000000002 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 64.0 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 70.299999999999997 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HZ2' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.099999999999994 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.420000000000002 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 53.43 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 71.319999999999993 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 65.129999999999995 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.528 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.030000000000001 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.528 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 54.329999999999998 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.120000000000005 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.439999999999998 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 80' ' ' MET . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.310000000000002 111.239 -176.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.319999999999993 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.019999999999996 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.319999999999993 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.120000000000005 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.432 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.240000000000002 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.775 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.120000000000005 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.535 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.010000000000005 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 64.230000000000004 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 61.539999999999999 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 40.020000000000003 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.130000000000003 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.200000000000003 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.519999999999996 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.430000000000007 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.109999999999999 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 65.239999999999995 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.420000000000002 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.040000000000006 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 65.3 t30 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.530000000000001 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.450000000000003 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.430000000000007 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.439 ' HG3' HD13 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.219999999999999 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.549999999999997 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.329999999999998 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CG ' ' H ' ' A' ' 67' ' ' MET . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.140000000000001 109.592 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 62.009999999999998 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.530000000000001 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.578 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.200000000000003 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.432 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.239999999999995 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 71.0 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.428 ' H ' ' CG ' ' A' ' 61' ' ' GLU . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.150000000000006 110.339 -176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 72.200000000000003 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.319999999999993 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.0 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 70.349999999999994 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.010000000000005 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.340000000000003 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.120000000000005 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.530000000000001 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.150000000000006 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.471 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.540000000000006 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.421 ' HB2' ' HB ' ' A' ' 35' ' ' VAL . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 72.209999999999994 112.074 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.120000000000005 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.519999999999996 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 62.229999999999997 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 87.3 mm-40 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 71.109999999999999 112.447 -174.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 73.439999999999998 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.219999999999999 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.578 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.530000000000001 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.423 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.209999999999994 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 71.510000000000005 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 70.400000000000006 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.423 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 70.239999999999995 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.543 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 70.450000000000003 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 62.299999999999997 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 63.219999999999999 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.239999999999995 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 64.340000000000003 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.349999999999994 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 54.210000000000001 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.420000000000002 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 54.200000000000003 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 52.229999999999997 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 72.530000000000001 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.669 ' HB2' HD11 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.299999999999997 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.140000000000001 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.010000000000005 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 63.009999999999998 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.542 HD22 ' HA ' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 61.25 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 63.329999999999998 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.340000000000003 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.450000000000003 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.450000000000003 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HA ' HD22 ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 54.420000000000002 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 64.209999999999994 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.129999999999995 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 73.030000000000001 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 73.109999999999999 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.329999999999998 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 70.239999999999995 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 72.340000000000003 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 120.873 0.368 . . . . 75.150000000000006 111.37 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.120000000000005 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.688 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.239999999999995 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.230000000000004 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 71.340000000000003 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.439999999999998 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 65.140000000000001 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.433 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.430000000000007 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.482 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.540000000000006 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 70.340000000000003 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.340000000000003 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.435 ' HE2' ' HB1' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 62.520000000000003 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 62.119999999999997 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.409999999999997 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.405 HG22 ' HG3' ' A' ' 24' ' ' GLU . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 63.32 110.617 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 71.299999999999997 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 64.120000000000005 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 50.119999999999997 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.732 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.25 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HG3' HG22 ' A' ' 18' ' ' THR . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 109.204 173.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.972 HD23 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.129999999999995 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.435 ' HB1' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 61.520000000000003 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 71.430000000000007 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.506 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.430000000000007 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 70.439999999999998 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.599 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 72.239999999999995 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.319999999999993 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 15.3 mm100 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 72.25 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.299999999999997 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.539 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.409999999999997 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.219999999999999 108.415 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.482 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.150000000000006 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.51 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.200000000000003 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.732 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 53.420000000000002 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.409999999999997 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 64.129999999999995 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 52.299999999999997 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.540000000000006 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.409999999999997 110.077 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 50.109999999999999 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 65.140000000000001 110.277 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.019999999999996 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.422 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 61.340000000000003 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 51.219999999999999 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.340000000000003 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 74.420000000000002 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 64.209999999999994 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.209999999999994 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 41.4 t30 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 72.040000000000006 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.549999999999997 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.219999999999999 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.329999999999998 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.150000000000006 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 72.430000000000007 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.430000000000007 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.109999999999999 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 40.25 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 54.109999999999999 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.439999999999998 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 62.109999999999999 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.299999999999997 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.566 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 72.530000000000001 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 64.340000000000003 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 61.210000000000001 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 70.510000000000005 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.129999999999995 107.121 167.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 55.439999999999998 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.420000000000002 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.402 HD13 ' HA ' ' A' ' 40' ' ' GLN . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 71.319999999999993 110.222 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.400000000000006 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.566 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.450000000000003 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.219999999999999 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.688 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.439999999999998 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.430000000000007 108.453 170.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 64.310000000000002 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' LEU . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 64.400000000000006 107.966 175.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 55.420000000000002 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.409999999999997 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 83' ' ' LEU . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.340000000000003 109.41 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.627 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.409999999999997 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.409999999999997 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.310000000000002 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.010000000000005 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.472 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.299999999999997 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 54.329999999999998 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.240000000000002 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.972 HD11 HD23 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.530000000000001 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 73.219999999999999 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.536 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 71.150000000000006 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 53.100000000000001 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.209999999999994 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 74.230000000000004 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 61.140000000000001 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.210000000000001 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.329999999999998 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.510000000000005 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.329999999999998 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 51.530000000000001 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.239999999999995 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 62.520000000000003 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.510000000000005 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.129999999999995 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 73.530000000000001 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.637 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.140000000000001 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 53.130000000000003 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 72.219999999999999 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 70.230000000000004 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.230000000000004 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.450000000000003 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.415 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 72.129999999999995 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.439999999999998 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.510000000000005 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm . . . . . 0 CA--C 1.53 0.178 0 N-CA-C 111.753 0.279 . . . . 75.519999999999996 111.753 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.416 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.109999999999999 111.457 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.478 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 70.439999999999998 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 44.350000000000001 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 65.420000000000002 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.77 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 64.310000000000002 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 10' ' ' LEU . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.099999999999994 108.823 176.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.407 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.200000000000003 109.931 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.340000000000003 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.209999999999994 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 70.150000000000006 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 71.409999999999997 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.514 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.239999999999995 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.010000000000005 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.465 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 24.239999999999998 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.998 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.209999999999994 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.998 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.450000000000003 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.099999999999994 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 42.439999999999998 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.299999999999997 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 65.219999999999999 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.140000000000001 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.230000000000004 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.540000000000006 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.219999999999999 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.404 HG22 ' HG3' ' A' ' 117' ' ' GLN . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 64.510000000000005 110.574 -176.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.540000000000006 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.039999999999999 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 54.549999999999997 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 41.420000000000002 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.76 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.420000000000002 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 64.5 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 11' ' ' SER . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.219999999999999 110.077 -178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.529 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.549999999999997 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.624 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 61.340000000000003 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.512 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.329999999999998 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.349999999999994 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 45.219999999999999 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.420000000000002 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.450000000000003 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.564 HD13 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 71.010000000000005 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.340000000000003 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 62.539999999999999 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.340000000000003 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.409999999999997 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 72.540000000000006 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.099999999999994 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 64.420000000000002 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 53.420000000000002 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.420000000000002 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 63.439999999999998 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 63.240000000000002 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 73.400000000000006 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 64.049999999999997 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 72.340000000000003 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.230000000000004 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.230000000000004 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.109999999999999 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.310000000000002 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.209999999999994 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.478 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 54.219999999999999 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.210000000000001 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.040000000000006 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.553 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.430000000000007 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.519999999999996 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.893 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 73.430000000000007 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 73.129999999999995 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 72.109999999999999 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 62.229999999999997 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 70.0 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.553 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.239999999999995 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 70.329999999999998 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.329999999999998 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.77 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.400000000000006 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.099999999999994 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.76 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 65.420000000000002 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.049999999999997 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.209999999999994 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.109999999999999 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 70.219999999999999 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 72.239999999999995 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.150000000000006 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.219999999999999 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 62.409999999999997 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.200000000000003 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.299999999999997 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.487 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 72.329999999999998 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.349999999999994 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.510000000000005 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.430000000000007 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.430000000000007 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 43.109999999999999 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.971 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.099999999999994 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.109999999999999 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.150000000000006 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 62.32 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.200000000000003 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 63.229999999999997 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 70.219999999999999 109.339 -177.195 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.299999999999997 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.409999999999997 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 65.140000000000001 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.030000000000001 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.219999999999999 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.109999999999999 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.586 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.519999999999996 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 73.319999999999993 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.529 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 71.540000000000006 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 119' ' ' GLU . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 65.329999999999998 110.735 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.200000000000003 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.130000000000003 111.725 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 63.32 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.540000000000006 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 53.32 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.120000000000005 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.682 0.277 . . . . 72.200000000000003 110.886 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.239999999999995 110.671 -178.62 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 77' ' ' GLU . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.319999999999993 110.415 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 73.019999999999996 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 61.25 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.450000000000003 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 61.219999999999999 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.349999999999994 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.604 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.530000000000001 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.450000000000003 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.450000000000003 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 71.409999999999997 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 61.310000000000002 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.628 HG22 HG22 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 73.120000000000005 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 54.509999999999998 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.628 HG22 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.219999999999999 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.319999999999993 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.471 ' H ' HG23 ' A' ' 21' ' ' THR . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 60.200000000000003 110.003 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HG2' ' HA ' ' A' ' 15' ' ' LYS . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.109999999999999 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.487 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.129999999999995 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 72.209999999999994 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 52.509999999999998 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 64.140000000000001 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 65.420000000000002 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 73.340000000000003 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.310000000000002 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.711 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 19.6 mm-40 -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.519999999999996 110.036 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.150000000000006 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.310000000000002 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.230000000000004 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 61.549999999999997 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.120000000000005 110.646 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 71.010000000000005 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.49 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.209999999999994 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.49 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.519999999999996 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.509 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.230000000000004 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.129999999999995 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 72.409999999999997 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.510000000000005 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.519999999999996 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.230000000000004 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 71.239999999999995 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 40.140000000000001 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.400000000000006 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.109999999999999 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 71.439999999999998 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 62.409999999999997 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.049999999999997 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 44.219999999999999 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.439999999999998 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 64.030000000000001 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 71.230000000000004 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HG3' ' HD2' ' A' ' 66' ' ' LYS . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 65.340000000000003 109.715 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.401 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 64.430000000000007 113.26 -173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.229999999999997 113.586 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 1.007 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 41.329999999999998 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 72.329999999999998 109.458 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.403 ' HD2' ' HG3' ' A' ' 61' ' ' GLU . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.239999999999995 109.65 176.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.409999999999997 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.219999999999999 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.150000000000006 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 74.140000000000001 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.815 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 62.210000000000001 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.420000000000002 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.230000000000004 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 61.420000000000002 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 63.329999999999998 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.329999999999998 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE1' ' HB3' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.329999999999998 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 67' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 64.519999999999996 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 54.420000000000002 110.875 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.602 ' HG3' ' N ' ' A' ' 82' ' ' LYS . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.329999999999998 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.602 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 52.039999999999999 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 1.007 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 64.049999999999997 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.319999999999993 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 71.340000000000003 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.239999999999995 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.499 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.310000000000002 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.492 ' HA2' HG23 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.399999999999999 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 51.130000000000003 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 64.120000000000005 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.783 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.129999999999995 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 71.319999999999993 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.329999999999998 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.099999999999994 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HB3' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.409999999999997 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.530000000000001 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 33.450000000000003 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 63.520000000000003 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 63.200000000000003 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 62.509999999999998 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.030000000000001 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 73.040000000000006 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.519999999999996 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 64.040000000000006 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 70.209999999999994 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.319999999999993 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.200000000000003 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.492 HG23 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.340000000000003 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.039999999999999 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 34.200000000000003 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.400000000000006 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.209999999999994 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 71.120000000000005 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.140000000000001 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 71.420000000000002 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 31' ' ' GLU . 45.0 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 73.319999999999993 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 63.409999999999997 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.230000000000004 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 60.130000000000003 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.150000000000006 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 62.409999999999997 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.329999999999998 112.593 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 62.43 112.16 -170.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 74.25 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 7' ' ' LEU . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 53.420000000000002 110.5 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.409999999999997 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.329999999999998 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.310000000000002 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.563 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.009999999999998 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.340000000000003 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.120000000000005 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.430000000000007 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.72 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 63.140000000000001 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.439999999999998 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 53.439999999999998 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG22 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.430000000000007 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.506 ' H ' HG22 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 61.520000000000003 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 63.149999999999999 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.409999999999997 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.310000000000002 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.598 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 71.439999999999998 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.310000000000002 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 53.409999999999997 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 51.009999999999998 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 63.219999999999999 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 72.319999999999993 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 121' ' ' GLU . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 64.120000000000005 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.319999999999993 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 73.510000000000005 112.188 -162.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 65.200000000000003 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.563 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 65.349999999999994 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.595 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.549999999999997 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 72.129999999999995 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.514 ' HB3' HD22 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.209999999999994 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.409999999999997 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 73.319999999999993 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 62.520000000000003 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.209999999999994 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 70.439999999999998 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.030000000000001 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 62.210000000000001 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.349999999999994 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.420000000000002 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.463 ' CG ' ' HB3' ' A' ' 96' ' ' GLN . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 63.43 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 73.409999999999997 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.409999999999997 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.549 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.109999999999999 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.608 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.319999999999993 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.430000000000007 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 62.109999999999999 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.409999999999997 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.109999999999999 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 63.450000000000003 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 71.549999999999997 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 73.420000000000002 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 64.439999999999998 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.129999999999995 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 64.329999999999998 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.150000000000006 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.481 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 41.520000000000003 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 63.439999999999998 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 64.310000000000002 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.239999999999995 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.299999999999997 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.219999999999999 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 65.409999999999997 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.430000000000007 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.509999999999998 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.420000000000002 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 64.430000000000007 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 72.129999999999995 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.442 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 63.420000000000002 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 71.049999999999997 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.65 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.340000000000003 109.749 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 53.030000000000001 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.463 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 64.540000000000006 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.310000000000002 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.51 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.329999999999998 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 74.519999999999996 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 74.329999999999998 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.439999999999998 109.882 176.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.608 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.109999999999999 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.040000000000006 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.53 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 51.329999999999998 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.582 ' HA ' HG22 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 52.130000000000003 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.349999999999994 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 63.509999999999998 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 74.349999999999994 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 52.509999999999998 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.329999999999998 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.413 ' O ' ' HB ' ' A' ' 95' ' ' ILE . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.140000000000001 111.975 175.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 64.409999999999997 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.598 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.120000000000005 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 65.420000000000002 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.510000000000005 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.562 HG13 HG11 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.430000000000007 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 64.430000000000007 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 63.119999999999997 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLY . . . . . 0.423 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.299999999999997 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.010000000000005 111.35 -176.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.562 HG11 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 71.200000000000003 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.019999999999996 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.329999999999998 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 72.319999999999993 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 64.340000000000003 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.53 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 65.230000000000004 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.409999999999997 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 33.32 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.478 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.450000000000003 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 55.420000000000002 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 112.031 0.382 . . . . 54.539999999999999 112.031 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 62.140000000000001 111.202 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 71.099999999999994 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.519999999999996 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.230000000000004 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 64.5 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.229999999999997 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.019999999999996 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.010000000000005 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 62.100000000000001 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.120000000000005 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 54.130000000000003 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 70.530000000000001 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.439999999999998 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 73.439999999999998 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.471 ' O ' HG13 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 54.340000000000003 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 74.040000000000006 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 63.310000000000002 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 65.099999999999994 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.828 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 72.530000000000001 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.493 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 61.329999999999998 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 52.409999999999997 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.584 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 72.109999999999999 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.439999999999998 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.129999999999995 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.631 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.239999999999995 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.631 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.439999999999998 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.430000000000007 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 53.9 mm-40 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 62.530000000000001 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 63.030000000000001 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 64.019999999999996 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.540000000000006 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.427 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.409999999999997 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.505 ' HB3' HD22 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 72.310000000000002 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.474 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.400000000000006 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 72.25 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.601 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 64.310000000000002 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.239999999999995 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.462 ' H ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 54.240000000000002 109.381 175.08 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 53.119999999999997 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.200000000000003 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.230000000000004 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.010000000000005 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 62.399999999999999 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 70.109999999999999 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 64.310000000000002 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.512 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 61.32 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 62.240000000000002 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 73.099999999999994 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.129999999999995 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 65.120000000000005 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 71.450000000000003 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.349999999999994 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.150000000000006 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.120000000000005 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.310000000000002 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.310000000000002 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 50.340000000000003 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.329999999999998 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 64.409999999999997 110.59 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 70.340000000000003 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 111.162 -175.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.430000000000007 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 72.540000000000006 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.510000000000005 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.129999999999995 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 43.25 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 65.340000000000003 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 60.530000000000001 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 54.439999999999998 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.019999999999996 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 61.140000000000001 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 72.430000000000007 109.32 177.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.230000000000004 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.099999999999994 110.766 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.310000000000002 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.310000000000002 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.239999999999995 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.529 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 65.310000000000002 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.529 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 62.340000000000003 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 63.32 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.451 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 44.340000000000003 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 63.119999999999997 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.439999999999998 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.310000000000002 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.219999999999999 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.686 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.010000000000005 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 73.450000000000003 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.209999999999994 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 64.540000000000006 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.140000000000001 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.614 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.409999999999997 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 72.439999999999998 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 55.109999999999999 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.614 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 73.109999999999999 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 64.0 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.299999999999997 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 72.450000000000003 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.828 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 64.409999999999997 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.409999999999997 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.409999999999997 109.112 -175.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 61.439999999999998 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 64.120000000000005 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.030000000000001 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 62.109999999999999 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.430000000000007 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.150000000000006 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.56 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 64.150000000000006 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.129999999999995 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.040000000000006 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 71.230000000000004 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.55 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.219999999999999 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.209999999999994 111.687 176.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.519999999999996 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 61.329999999999998 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.040000000000006 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.209999999999994 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.688 0.28 . . . . 70.219999999999999 111.058 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.540000000000006 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 64.530000000000001 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 54.229999999999997 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.310000000000002 110.396 174.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 65.239999999999995 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.319999999999993 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.109999999999999 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 74.439999999999998 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.030000000000001 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 73.409999999999997 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.607 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 55.009999999999998 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 51.009999999999998 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.400000000000006 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.787 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.340000000000003 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.787 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.519999999999996 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.455 ' H ' HG23 ' A' ' 19' ' ' VAL . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.140000000000001 111.087 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.8 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 62.509999999999998 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.340000000000003 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.219999999999999 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.579 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 71.129999999999995 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 63.130000000000003 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 63.509999999999998 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.510000000000005 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 45.219999999999999 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.603 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.530000000000001 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 55.240000000000002 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 65.25 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.466 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.340000000000003 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.450000000000003 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.591 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.129999999999995 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.483 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.120000000000005 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 64.349999999999994 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 52.539999999999999 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 71.030000000000001 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 73.439999999999998 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.319999999999993 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.8 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 73.0 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.588 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 41.409999999999997 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.200000000000003 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 65.049999999999997 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 64.219999999999999 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 64.540000000000006 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.200000000000003 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.040000000000006 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.423 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.430000000000007 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 62.340000000000003 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.542 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.646 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.340000000000003 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.039999999999999 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.549999999999997 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.439999999999998 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 73.010000000000005 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.109999999999999 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.150000000000006 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.329999999999998 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.140000000000001 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.329999999999998 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.812 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 73.140000000000001 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.481 ' CD1' ' HE2' ' A' ' 80' ' ' MET . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 111.029 -170.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.219999999999999 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.299999999999997 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 60.420000000000002 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 70.230000000000004 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 62.399999999999999 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.340000000000003 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.120000000000005 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 55.25 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 64.010000000000005 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.545 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 64.400000000000006 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.558 ' HG2' HD21 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.430000000000007 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.553 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 52.149999999999999 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 62.200000000000003 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.591 ' HB3' ' HB ' ' A' ' 35' ' ' VAL . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.219999999999999 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 61.229999999999997 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.466 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.010000000000005 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.812 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 61.299999999999997 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 55.039999999999999 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.210000000000001 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.319999999999993 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 74.329999999999998 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.461 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.219999999999999 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 32.020000000000003 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.030000000000001 109.227 173.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.689 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 55.229999999999997 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.542 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.010000000000005 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.019999999999996 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 45.399999999999999 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.030000000000001 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.340000000000003 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.510000000000005 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.109999999999999 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 54.030000000000001 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 73.540000000000006 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.209999999999994 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.099999999999994 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.409999999999997 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.450000000000003 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 50.229999999999997 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 71.439999999999998 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.424 HD22 ' HB2' ' A' ' 113' ' ' TYR . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.310000000000002 110.297 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.461 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 71.329999999999998 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 53.350000000000001 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.661 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.519999999999996 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 72.109999999999999 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.424 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.030000000000001 112.437 -175.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 54.310000000000002 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.129999999999995 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.401 ' HG ' HD11 ' A' ' 106' ' ' LEU . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 64.549999999999997 110.497 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 62.130000000000003 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 73.329999999999998 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.230000000000004 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.420000000000002 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.430000000000007 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.420000000000002 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.815 0.672 . . . . 72.299999999999997 112.815 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 73.409999999999997 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 50.520000000000003 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 72.310000000000002 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.209999999999994 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' HB2' ' HD1' ' A' ' 79' ' ' PHE . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.200000000000003 110.99 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.519999999999996 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 61.200000000000003 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.129999999999995 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 62.509999999999998 109.715 178.825 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.430000000000007 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 72.400000000000006 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 73.209999999999994 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.319999999999993 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 65.420000000000002 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 70.019999999999996 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.150000000000006 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.439999999999998 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.340000000000003 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.239999999999995 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 70.099999999999994 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 72.230000000000004 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.130000000000003 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.209999999999994 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.299999999999997 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 72.319999999999993 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 44.229999999999997 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.459 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 62.43 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.430000000000007 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.329999999999998 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.340000000000003 111.984 -169.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.549999999999997 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.595 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 73.329999999999998 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' HD21 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 71.099999999999994 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.439999999999998 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 72.409999999999997 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 72.140000000000001 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.420000000000002 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.239999999999995 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.519999999999996 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 64.310000000000002 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.43 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 60.509999999999998 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 51.039999999999999 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 64.25 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.439999999999998 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 73.200000000000003 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 94' ' ' GLN . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.130000000000003 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.319999999999993 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 70.209999999999994 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.310000000000002 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.0 t30 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 62.310000000000002 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 72.319999999999993 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.510000000000005 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.140000000000001 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.537 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 54.43 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.409999999999997 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 71.439999999999998 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.040000000000006 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.340000000000003 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.408 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.530000000000001 109.9 -175.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.646 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.530000000000001 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.099999999999994 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.049999999999997 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.409999999999997 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.43 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.350000000000001 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.010000000000005 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.030000000000001 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 71.109999999999999 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.576 ' CA ' HD22 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.299999999999997 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.530000000000001 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.427 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 70.310000000000002 109.125 172.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 64.430000000000007 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.239999999999995 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.463 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.549999999999997 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.486 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.510000000000005 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 61.25 110.699 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.498 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 63.439999999999998 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.875 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.109999999999999 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.530000000000001 109.735 178.966 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.875 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.219999999999999 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.340000000000003 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.605 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.230000000000004 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.299999999999997 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.487 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 71.230000000000004 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.591 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.329999999999998 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 73.329999999999998 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.409999999999997 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 74.540000000000006 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.703 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.010000000000005 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 64.510000000000005 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.439999999999998 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.519999999999996 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.239999999999995 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 22.43 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 47.3 p-80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.450000000000003 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.150000000000006 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 63.219999999999999 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.417 ' HG ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 61.32 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.450000000000003 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 60.140000000000001 110.287 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.605 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 71.219999999999999 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.150000000000006 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.400000000000006 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.409999999999997 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.631 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.219999999999999 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.349999999999994 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 61.130000000000003 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 116' ' ' LEU . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 61.130000000000003 110.699 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.420000000000002 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.040000000000006 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.424 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 62.119999999999997 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.230000000000004 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 60.43 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.420000000000002 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.882 0.372 . . . . 74.140000000000001 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 74.310000000000002 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.409999999999997 109.124 172.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' HD12 ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 64.219999999999999 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 63.219999999999999 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.25 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.310000000000002 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.468 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 61.549999999999997 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 63.43 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 64.140000000000001 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.409999999999997 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.562 ' HB2' HG23 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.329999999999998 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.614 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.420000000000002 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.109999999999999 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.230000000000004 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.561 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.400000000000006 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 62.119999999999997 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 61.0 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.723 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 64.030000000000001 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.439999999999998 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 71.120000000000005 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.140000000000001 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.429 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.549999999999997 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 71.040000000000006 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.409999999999997 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.129999999999995 109.019 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 63.340000000000003 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 73.340000000000003 110.013 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 64.129999999999995 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.150000000000006 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.140000000000001 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.540000000000006 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.549999999999997 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.429 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 73.319999999999993 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.562 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 52.409999999999997 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 61.520000000000003 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.450000000000003 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.604 HD11 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.510000000000005 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.239999999999995 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 60.509999999999998 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.129999999999995 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.450000000000003 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.25 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 54.539999999999999 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 74.519999999999996 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.349999999999994 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 73.25 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.435 ' HB3' HG23 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 74.150000000000006 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 60.5 t30 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 71.450000000000003 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 63.310000000000002 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 71.530000000000001 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 63.130000000000003 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.435 HG23 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.010000000000005 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.030000000000001 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 72.340000000000003 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 43.450000000000003 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.430000000000007 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.099999999999994 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.403 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.120000000000005 109.182 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.299999999999997 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.409999999999997 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 73.430000000000007 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.409999999999997 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.010000000000005 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.604 ' HA2' HD11 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 42.340000000000003 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.409999999999997 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.562 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 63.420000000000002 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.010000000000005 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.518 ' HG2' ' HG3' ' A' ' 80' ' ' MET . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.310000000000002 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.518 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.239999999999995 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.519999999999996 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 63.420000000000002 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.466 ' H ' ' CB ' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 54.109999999999999 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 73.150000000000006 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.129999999999995 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.439999999999998 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.319999999999993 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.509 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.200000000000003 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.200000000000003 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.109999999999999 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.487 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.430000000000007 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.340000000000003 110.508 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.109999999999999 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.427 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.120000000000005 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.140000000000001 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.439999999999998 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 61.210000000000001 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.120000000000005 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.429 ' HB2' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 65.420000000000002 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.010000000000005 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.230000000000004 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.349999999999994 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.150000000000006 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 71.430000000000007 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 63.340000000000003 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 54.039999999999999 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 61.310000000000002 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.509 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 72.230000000000004 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.100000000000001 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.510000000000005 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 64.540000000000006 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.531 ' HA ' HD22 ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.030000000000001 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.687 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 64.019999999999996 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 73.549999999999997 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.340000000000003 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.605 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.549999999999997 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.219999999999999 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 70.310000000000002 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 34.0 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 70.25 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.430000000000007 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 121.099 0.476 . . . . 63.509999999999998 110.605 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 72.310000000000002 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 73.430000000000007 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 72.340000000000003 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.475 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 55.350000000000001 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.040000000000006 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.439999999999998 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.239999999999995 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.430000000000007 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 61.409999999999997 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 65.340000000000003 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.507 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.430000000000007 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.735 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 62.25 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.735 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 53.43 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 64.319999999999993 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.428 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.400000000000006 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.400000000000006 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.219999999999999 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 63.149999999999999 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 55.32 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 40' ' ' GLN . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.150000000000006 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.329999999999998 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.540000000000006 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.109999999999999 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.230000000000004 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.458 ' H ' HD12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 53.009999999999998 110.384 -175.702 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 71.420000000000002 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.818 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.349999999999994 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 72.349999999999994 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.400000000000006 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 65.140000000000001 110.292 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.439999999999998 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 70.409999999999997 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 73.430000000000007 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.574 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.543 ' HG2' ' HB3' ' A' ' 24' ' ' GLU . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.439999999999998 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.109999999999999 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.120000000000005 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.540000000000006 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.409999999999997 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 71.530000000000001 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.439999999999998 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 53.039999999999999 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 43.119999999999997 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 72.209999999999994 110.108 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.594 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 54.450000000000003 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.340000000000003 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 72.140000000000001 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.239999999999995 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.492 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 73.030000000000001 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.219999999999999 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 72.140000000000001 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 73.319999999999993 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.230000000000004 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.492 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.230000000000004 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.150000000000006 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 65' ' ' TYR . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 71.299999999999997 110.49 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.209999999999994 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.140000000000001 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 71.140000000000001 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.431 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 72.150000000000006 111.26 -176.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 73.109999999999999 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.421 ' HB2' ' HE3' ' A' ' 78' ' ' MET . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.299999999999997 111.479 -169.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.219999999999999 109.702 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 62.210000000000001 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.32 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.530000000000001 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 63.200000000000003 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.310000000000002 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 34.350000000000001 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 73.319999999999993 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.574 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 71.230000000000004 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.549999999999997 110.614 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.544 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.030000000000001 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.040000000000006 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.540000000000006 112.598 -172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.569 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.310000000000002 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 73.230000000000004 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 73.030000000000001 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.523 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.150000000000006 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.200000000000003 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.523 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 55.329999999999998 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.540000000000006 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.450000000000003 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.209999999999994 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 72.239999999999995 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.310000000000002 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 65.129999999999995 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.495 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 61.520000000000003 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.010000000000005 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.594 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.439999999999998 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.150000000000006 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.150000000000006 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.401 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 64.010000000000005 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 43.32 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.230000000000004 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.129999999999995 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 50.509999999999998 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.230000000000004 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.446 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.319999999999993 108.968 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.109999999999999 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 55.229999999999997 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.540000000000006 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.329999999999998 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.409999999999997 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 73.230000000000004 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 64.109999999999999 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.319999999999993 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.200000000000003 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 29' ' ' ILE . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 63.409999999999997 110.513 177.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.349999999999994 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.310000000000002 111.489 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.319999999999993 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 50.0 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.818 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 61.439999999999998 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 50.020000000000003 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.099 0.476 . . . . 70.420000000000002 110.485 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.439999999999998 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 64.129999999999995 111.328 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.200000000000003 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.340000000000003 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.559 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.239999999999995 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 65.299999999999997 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 64.140000000000001 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.230000000000004 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.420000000000002 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.409999999999997 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.200000000000003 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.310000000000002 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 51.409999999999997 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 73.519999999999996 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 64.129999999999995 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 72.239999999999995 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.230000000000004 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 73.120000000000005 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.71 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.340000000000003 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 70.310000000000002 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 71.200000000000003 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 64.409999999999997 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.530000000000001 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.645 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.420000000000002 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.010000000000005 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 62.100000000000001 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.299999999999997 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 73.299999999999997 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.559 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 62.009999999999998 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.71 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.319999999999993 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.530000000000001 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 55.439999999999998 110.21 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.019999999999996 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.349999999999994 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.319999999999993 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.420000000000002 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 71.409999999999997 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 61.130000000000003 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.430000000000007 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.030000000000001 109.169 172.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.68 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.310000000000002 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 71.340000000000003 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 72.25 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 61.409999999999997 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.239999999999995 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.040000000000006 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 59' ' ' ILE . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.209999999999994 109.268 173.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 64.1 t30 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.430000000000007 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.510000000000005 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 65.109999999999999 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.019999999999996 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.406 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 73.25 112.126 -173.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.019999999999996 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.409999999999997 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.200000000000003 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 65.120000000000005 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.701 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 65.200000000000003 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.573 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.439999999999998 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HB2' ' A' ' 61' ' ' GLU . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 65.129999999999995 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.51 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.329999999999998 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.239999999999995 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.319999999999993 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 70.030000000000001 109.726 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.409999999999997 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.450000000000003 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.329999999999998 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 64.209999999999994 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 62.229999999999997 110.001 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.519999999999996 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.603 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 64.310000000000002 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.230000000000004 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 31.239999999999998 111.74 -178.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.439999999999998 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.510000000000005 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 95.2 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.120000000000005 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.109999999999999 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.439999999999998 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.701 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.53 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.109999999999999 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.150000000000006 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.010000000000005 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.629 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.219999999999999 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 73.219999999999999 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.200000000000003 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.150000000000006 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 71.439999999999998 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 73.439999999999998 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 43.329999999999998 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.420000000000002 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.140000000000001 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.431 HG22 ' HA ' ' A' ' 96' ' ' GLN . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.340000000000003 111.296 177.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.219999999999999 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.430000000000007 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 52.200000000000003 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 62.210000000000001 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 72.239999999999995 108.849 -178.869 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.439999999999998 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.299999999999997 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.53 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 73.209999999999994 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 34.32 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.329999999999998 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 63.109999999999999 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.030000000000001 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 74.540000000000006 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.450000000000003 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 70.519999999999996 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.512 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.329999999999998 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 118' ' ' LYS . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.319999999999993 111.079 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 65.200000000000003 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 42.229999999999997 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 65.430000000000007 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 71.150000000000006 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.614 0.598 . . . . 72.120000000000005 112.614 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 61.240000000000002 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 72.310000000000002 111.353 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.200000000000003 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.420000000000002 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 63.109999999999999 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 62.149999999999999 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.039999999999999 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 71.400000000000006 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.548 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.239999999999995 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.319999999999993 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.729 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 74.409999999999997 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 64.200000000000003 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.130000000000003 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 60.340000000000003 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 63.219999999999999 109.741 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 53.219999999999999 113.128 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 23' ' ' SER . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 54.25 109.203 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.140000000000001 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 53.299999999999997 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.200000000000003 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 61.200000000000003 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.310000000000002 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 55.409999999999997 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.418 HD13 ' HB3' ' A' ' 116' ' ' LEU . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 71.510000000000005 110.898 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.240000000000002 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.019999999999996 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 63.119999999999997 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 34.119999999999997 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 19.9 mm-40 -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 72.340000000000003 110.292 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.510000000000005 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.319999999999993 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.507 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 71.430000000000007 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.519999999999996 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.219999999999999 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.310000000000002 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.492 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 71.010000000000005 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.492 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 70.430000000000007 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.841 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 60.229999999999997 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 70.140000000000001 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 61.149999999999999 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.349999999999994 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 63.25 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 64.129999999999995 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.140000000000001 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.462 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 65.25 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 71.219999999999999 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.804 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 73.530000000000001 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 71.239999999999995 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.219999999999999 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.340000000000003 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 73.349999999999994 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.340000000000003 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.457 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.409999999999997 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 70.209999999999994 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 54.539999999999999 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.430000000000007 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.209999999999994 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.230000000000004 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.040000000000006 109.414 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.140000000000001 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.450000000000003 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 71.230000000000004 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 65.340000000000003 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.140000000000001 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.841 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 63.340000000000003 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 73.530000000000001 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 34.409999999999997 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 62.0 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 72.099999999999994 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 72.340000000000003 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 72.209999999999994 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 51.409999999999997 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.049999999999997 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.43 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.209999999999994 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 44.32 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.299999999999997 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.219999999999999 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 52.140000000000001 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.209999999999994 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.239999999999995 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.310000000000002 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.200000000000003 109.54 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.430000000000007 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.430000000000007 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 70.409999999999997 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.804 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 60.049999999999997 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.119999999999997 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.349999999999994 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.099999999999994 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.120000000000005 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.430000000000007 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.040000000000006 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.340000000000003 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.329999999999998 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.329999999999998 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.209999999999994 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 60.439999999999998 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.319999999999993 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 63.310000000000002 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 64.230000000000004 108.756 177.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.409999999999997 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 63.229999999999997 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 63.399999999999999 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.200000000000003 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.209999999999994 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.010000000000005 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.310000000000002 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 61.229999999999997 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.418 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.310000000000002 110.023 177.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 1.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.409999999999997 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 62.420000000000002 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.310000000000002 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 61.109999999999999 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.340000000000003 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.120000000000005 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.463 0.207 0 N-CA-C 112.004 0.372 . . . . 70.540000000000006 112.004 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.581 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 71.129999999999995 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 64.450000000000003 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.637 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 63.130000000000003 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.010000000000005 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.109999999999999 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 72.340000000000003 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 64.349999999999994 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 64.319999999999993 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.120000000000005 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.420000000000002 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.636 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.129999999999995 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.96 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.420000000000002 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.96 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 65.030000000000001 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.675 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 72.230000000000004 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 43.329999999999998 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.099999999999994 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.099999999999994 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.140000000000001 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 43.450000000000003 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.239999999999995 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.669 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 61.539999999999999 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.534 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 65.510000000000005 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.450000000000003 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.933 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 73.420000000000002 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.310000000000002 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 52.210000000000001 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.420000000000002 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.409999999999997 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.722 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.510000000000005 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 72.310000000000002 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.549999999999997 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.441 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 71.299999999999997 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 73.400000000000006 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.744 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 54.219999999999999 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 62.25 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 74.230000000000004 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.530000000000001 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.409999999999997 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.519999999999996 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.634 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 53.420000000000002 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.150000000000006 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.519999999999996 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.109999999999999 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.534 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 64.109999999999999 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.633 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 72.420000000000002 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 63.200000000000003 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.329999999999998 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 61.409999999999997 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 61.409999999999997 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.420000000000002 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 64.200000000000003 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.329999999999998 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.109999999999999 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 50.539999999999999 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.763 ' HG3' ' HB3' ' A' ' 87' ' ' ASP . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 65.040000000000006 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 71.219999999999999 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 65.349999999999994 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.130000000000003 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 64.209999999999994 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.430000000000007 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.219999999999999 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 63.229999999999997 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.130000000000003 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 25.420000000000002 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 71.25 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.441 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 72.510000000000005 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 60.530000000000001 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.624 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.299999999999997 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 64.430000000000007 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.140000000000001 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.755 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 71.230000000000004 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.030000000000001 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.010000000000005 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.040000000000006 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.763 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.310000000000002 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.43 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.219999999999999 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.575 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 62.240000000000002 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 71.120000000000005 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.43 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 71.030000000000001 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.633 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 61.200000000000003 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.534 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.200000000000003 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.129999999999995 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.458 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.120000000000005 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.340000000000003 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.219999999999999 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.644 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.439999999999998 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.209999999999994 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.240000000000002 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.531 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.120000000000005 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 44.329999999999998 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 71.510000000000005 108.783 177.833 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.430000000000007 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.575 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 44.100000000000001 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.019999999999996 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.340000000000003 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.57 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 73.329999999999998 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 64.420000000000002 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 64.329999999999998 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 51.119999999999997 110.822 -179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.933 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.030000000000001 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.540000000000006 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 72.030000000000001 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.439999999999998 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 73.319999999999993 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.310000000000002 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.234 0.238 0 N-CA-C 112.518 0.562 . . . . 74.109999999999999 112.518 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.209999999999994 110.864 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 65.219999999999999 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.209999999999994 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.230000000000004 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.400000000000006 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.340000000000003 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 52.549999999999997 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.540000000000006 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.450000000000003 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.140000000000001 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 72.219999999999999 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.529 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.349999999999994 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.529 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.340000000000003 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.129999999999995 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.789 HG21 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 72.109999999999999 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.530000000000001 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.510000000000005 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.441 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.420000000000002 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.678 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.430000000000007 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.789 ' HB2' HG21 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 44.229999999999997 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 72.019999999999996 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.239999999999995 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 70.420000000000002 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 53.350000000000001 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.597 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 71.329999999999998 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 71.319999999999993 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.450000000000003 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.651 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 65.030000000000001 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 71.400000000000006 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 62.450000000000003 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.219999999999999 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.030000000000001 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 72.230000000000004 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.414 ' HE1' ' HG2' ' A' ' 28' ' ' GLU . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.349999999999994 111.203 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 62.420000000000002 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.530000000000001 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.209999999999994 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.230000000000004 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.230000000000004 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.409999999999997 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.319999999999993 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.129999999999995 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 54.340000000000003 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.120000000000005 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.230000000000004 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 61.229999999999997 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.109999999999999 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.444 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.140000000000001 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 65.430000000000007 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HB2' HD13 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 71.430000000000007 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 64.129999999999995 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HA ' HG23 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 71.439999999999998 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.319999999999993 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.593 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 74.349999999999994 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.219999999999999 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.239999999999995 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.329999999999998 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.446 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.150000000000006 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.099999999999994 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 72.219999999999999 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.613 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.400000000000006 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 64.340000000000003 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 73.209999999999994 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.019999999999996 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' A' ' 75' ' ' ILE . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.040000000000006 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.010000000000005 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.44 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.519999999999996 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 44.509999999999998 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.44 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.099999999999994 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.420000000000002 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.409999999999997 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.613 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 62.32 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 54.340000000000003 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 73.450000000000003 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 74.010000000000005 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.140000000000001 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 71.540000000000006 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.140000000000001 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 64.340000000000003 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 74.140000000000001 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 54.229999999999997 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 64.340000000000003 107.502 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.578 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.319999999999993 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 65.340000000000003 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.109999999999999 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.628 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.239999999999995 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 70.219999999999999 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.329999999999998 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 65.409999999999997 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.420000000000002 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.678 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.299999999999997 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 71.010000000000005 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 61.509999999999998 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 72.040000000000006 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 73.319999999999993 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.040000000000006 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 71.219999999999999 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.340000000000003 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 63.299999999999997 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.230000000000004 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 73.120000000000005 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.049999999999997 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.578 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 64.530000000000001 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.219999999999999 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.632 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.420000000000002 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.109999999999999 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.525 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.109999999999999 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 74.349999999999994 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 53.539999999999999 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 72.239999999999995 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.574 ' N ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 50.399999999999999 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 63.149999999999999 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.420000000000002 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.597 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 65.329999999999998 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 63.009999999999998 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.319999999999993 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.963 0.411 . . . . 74.140000000000001 110.719 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 74.310000000000002 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.409999999999997 110.252 176.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 64.219999999999999 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 63.219999999999999 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.25 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.310000000000002 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 61.549999999999997 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 63.43 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 64.140000000000001 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.409999999999997 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.329999999999998 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.496 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.420000000000002 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.109999999999999 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.230000000000004 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.400000000000006 110.144 173.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 62.119999999999997 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 61.0 108.508 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 64.030000000000001 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.439999999999998 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.427 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 71.120000000000005 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.616 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.140000000000001 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.485 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.409999999999997 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.549999999999997 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 71.040000000000006 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.409999999999997 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.129999999999995 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 63.340000000000003 112.113 -174.02 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 64.129999999999995 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.42 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.150000000000006 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.140000000000001 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.488 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.540000000000006 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.549999999999997 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 73.319999999999993 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 52.409999999999997 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 61.520000000000003 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.450000000000003 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.319999999999993 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.510000000000005 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.239999999999995 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 60.509999999999998 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.129999999999995 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.450000000000003 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.25 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 54.539999999999999 109.869 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 74.519999999999996 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 59' ' ' ILE . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.349999999999994 108.814 173.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.46 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 73.25 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 74.150000000000006 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 71.450000000000003 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HA ' HG23 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 63.310000000000002 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 71.530000000000001 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 63.130000000000003 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 64.040000000000006 111.029 -176.339 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 67' ' ' MET . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.010000000000005 110.319 -176.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.030000000000001 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 72.340000000000003 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.513 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 43.450000000000003 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.430000000000007 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.099999999999994 109.582 171.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.484 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.120000000000005 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.299999999999997 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.409999999999997 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.411 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.991 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.010000000000005 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 42.340000000000003 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.409999999999997 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 63.420000000000002 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.63 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.010000000000005 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.129999999999995 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.310000000000002 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.43 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.239999999999995 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.519999999999996 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.019999999999996 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 63.420000000000002 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 54.109999999999999 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 73.150000000000006 109.662 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.129999999999995 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.513 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.439999999999998 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.319999999999993 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.504 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.200000000000003 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.200000000000003 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.109999999999999 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.430000000000007 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.481 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.340000000000003 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.109999999999999 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.120000000000005 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.439999999999998 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 61.210000000000001 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.120000000000005 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 65.420000000000002 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.010000000000005 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.230000000000004 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' HIS . . . . . 0.481 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.349999999999994 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.150000000000006 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.408 ' HG ' ' HG ' ' A' ' 108' ' ' LEU . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 63.340000000000003 110.669 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' VAL . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 54.039999999999999 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 61.310000000000002 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ILE . . . . . 0.504 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 72.230000000000004 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.100000000000001 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . 0.637 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.510000000000005 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 64.540000000000006 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HA ' HD22 ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.030000000000001 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 64.019999999999996 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 73.549999999999997 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.417 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.340000000000003 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.409 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.549999999999997 111.765 -176.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.219999999999999 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 70.310000000000002 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 34.0 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 70.25 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.430000000000007 110.289 -177.942 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.726 0.298 . . . . 73.310000000000002 110.673 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -166.59 -56.25 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.803 -0.635 . . . . 65.340000000000003 109.319 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.526 ' OE1' ' HD2' ' A' ' 66' ' ' LYS . 25.2 mm-40 -74.51 83.62 2.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.547 -0.751 . . . . 63.149999999999999 111.362 178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm -76.51 -31.46 57.71 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.511 -0.551 . . . . 61.399999999999999 109.511 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HA ' HD23 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 73.549999999999997 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 65.349999999999994 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.010000000000005 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 43.43 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 52.229999999999997 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.499 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 71.540000000000006 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.319999999999993 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.239999999999995 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 50.25 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.709 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.439999999999998 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.709 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.149999999999999 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.329999999999998 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.634 HG11 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.219999999999999 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 72.319999999999993 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.310000000000002 109.599 178.088 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 64.129999999999995 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.702 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 62.030000000000001 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.634 ' HG2' HG11 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.409999999999997 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.705 HD23 HD11 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 43.130000000000003 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 44.119999999999997 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 73.109999999999999 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.450000000000003 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.319999999999993 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.821 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 70.299999999999997 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.705 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.049999999999997 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.350000000000001 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.821 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 21.3 mm-40 -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.450000000000003 110.625 -176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.099999999999994 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.565 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.340000000000003 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 11' ' ' SER . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.109999999999999 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.58 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.129999999999995 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.702 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 71.519999999999996 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 62.340000000000003 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 65.109999999999999 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.450000000000003 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.310000000000002 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 55.439999999999998 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 71.209999999999994 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 70.400000000000006 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.540000000000006 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.329999999999998 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.458 HG21 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.409999999999997 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.408 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 63.549999999999997 109.909 175.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.567 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.430000000000007 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.319999999999993 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 72.239999999999995 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.7 t30 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 70.299999999999997 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.040000000000006 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.140000000000001 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 64.329999999999998 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.530000000000001 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.310000000000002 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.561 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 74.430000000000007 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 72.439999999999998 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.420000000000002 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.641 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.120000000000005 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.420000000000002 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.561 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.400000000000006 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.494 ' HB2' ' HE2' ' A' ' 78' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.129999999999995 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.264 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.671 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.040000000000006 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.439999999999998 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 72.310000000000002 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.510000000000005 110.549 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.240000000000002 110.021 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.555 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.310000000000002 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.409999999999997 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.671 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 53.210000000000001 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.502 ' HG3' HG22 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.530000000000001 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.534 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.299999999999997 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.734 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.349999999999994 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 73.349999999999994 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.420000000000002 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 71.120000000000005 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.641 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.409999999999997 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.475 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 71.310000000000002 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.430000000000007 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 44.340000000000003 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 52.140000000000001 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 64.230000000000004 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.542 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.209999999999994 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.439999999999998 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.469 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 72.430000000000007 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.587 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.530000000000001 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.239999999999995 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.408 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 74.530000000000001 111.061 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.705 HD11 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 64.010000000000005 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.230000000000004 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 60.329999999999998 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.109999999999999 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 71.030000000000001 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 63.039999999999999 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 62.32 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.310000000000002 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 61.420000000000002 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 64.439999999999998 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.422 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 71.239999999999995 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 52.219999999999999 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 72.109999999999999 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.542 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.420000000000002 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 71.349999999999994 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 73.239999999999995 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.656 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 63.0 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.030000000000001 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.428 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.219999999999999 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.514 HE21 ' CA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 55.43 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 72.120000000000005 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 62.210000000000001 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.400000000000006 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.705 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.430000000000007 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.340000000000003 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.715 -0.476 . . . . 74.25 109.715 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -130.68 135.18 47.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.43 -177.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.83 111.19 2.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.878 -0.601 . . . . 71.120000000000005 110.565 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm -67.38 -20.73 65.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 75.150000000000006 111.138 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 52.229999999999997 110.257 177.409 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.547 HH11 ' HB2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 73.329999999999998 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 64.349999999999994 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.310000000000002 111.349 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.415 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 44.140000000000001 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 63.25 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.109999999999999 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.563 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.340000000000003 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 72.310000000000002 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.815 ' HG3' ' HB2' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.040000000000006 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.45 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.010000000000005 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.109999999999999 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 61.140000000000001 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.687 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 53.030000000000001 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.687 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.109999999999999 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.049999999999997 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 42' ' ' GLU . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.439999999999998 110.374 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.319999999999993 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 60.439999999999998 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.815 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.310000000000002 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.230000000000004 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.556 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 73.510000000000005 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.109999999999999 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 53.340000000000003 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 65.140000000000001 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.329999999999998 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.140000000000001 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 80.9 mm-40 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.310000000000002 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 53.32 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.556 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 71.530000000000001 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 72.209999999999994 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.563 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 64.200000000000003 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HB3' HD22 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.409999999999997 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.150000000000006 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 60.100000000000001 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.049999999999997 110.896 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.669 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 62.109999999999999 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 44.039999999999999 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.420000000000002 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.239999999999995 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.669 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.219999999999999 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 51.149999999999999 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.632 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 71.409999999999997 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.47 HG22 HG23 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.209999999999994 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.422 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 71.299999999999997 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.099999999999994 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.310000000000002 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HB3' HG21 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 74.400000000000006 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.4 t30 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.240000000000002 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 64.420000000000002 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 70.319999999999993 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.230000000000004 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.420000000000002 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.400000000000006 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.487 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.510000000000005 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 33.210000000000001 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 65.129999999999995 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.030000000000001 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.200000000000003 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.510000000000005 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.150000000000006 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 71.430000000000007 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.420000000000002 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 52.140000000000001 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 65.439999999999998 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.549999999999997 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.219999999999999 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 72.140000000000001 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.439999999999998 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.763 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 65.209999999999994 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.519999999999996 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 70.239999999999995 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.510000000000005 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 65.219999999999999 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.558 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.409999999999997 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.558 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 62.299999999999997 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.239999999999995 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 63.340000000000003 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.45 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.209999999999994 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' LEU . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.420000000000002 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.420000000000002 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 55.409999999999997 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 71.409999999999997 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 63.32 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.120000000000005 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.422 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 50.100000000000001 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.47 HG23 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.632 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.519999999999996 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.239999999999995 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 60.049999999999997 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 63.039999999999999 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.430000000000007 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG11 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.209999999999994 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.450000000000003 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.200000000000003 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.140000000000001 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.540000000000006 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.129999999999995 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.329999999999998 109.577 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.540000000000006 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 51.43 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 30.129999999999999 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 65.129999999999995 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 73.0 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 64.099999999999994 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 61.520000000000003 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 62.020000000000003 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 73.409999999999997 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.239999999999995 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.439999999999998 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.150000000000006 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.477 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 41.520000000000003 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 61.100000000000001 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 109.917 -0.401 . . . . 71.129999999999995 109.917 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -106.07 121.0 43.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.374 -0.375 . . . . 74.310000000000002 111.615 -177.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.586 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 41.0 mt-10 -107.33 108.47 19.86 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.078 -0.712 . . . . 45.329999999999998 109.078 168.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt -76.44 -36.56 57.87 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.081 0.467 . . . . 62.520000000000003 110.077 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.510000000000005 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.586 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.439999999999998 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.010000000000005 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.109999999999999 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.47 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.119999999999997 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.239999999999995 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.239999999999995 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.519999999999996 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 64.439999999999998 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.517 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.239999999999995 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.439999999999998 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 64.430000000000007 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 61.229999999999997 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.329999999999998 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.552 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 70.430000000000007 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.984 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 54.43 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.209999999999994 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 17' ' ' PRO . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.109999999999999 109.409 -178.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.47 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 71.430000000000007 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.129999999999995 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.349999999999994 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 63.030000000000001 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.229999999999997 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.592 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 60.299999999999997 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.510000000000005 111.859 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 81' ' ' GLU . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 44.240000000000002 110.141 -176.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 64.409999999999997 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.409999999999997 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 72.200000000000003 109.828 173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.566 ' HB3' HD22 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 71.25 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 62.509999999999998 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 74.040000000000006 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.984 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.129999999999995 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 63.119999999999997 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.493 HD11 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 64.25 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 72.319999999999993 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.310000000000002 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.019999999999996 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.120000000000005 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.474 HG22 HG23 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.219999999999999 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.109999999999999 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.540000000000006 109.285 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.549999999999997 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 64.120000000000005 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.219999999999999 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.403 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.310000000000002 112.194 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.010000000000005 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.099999999999994 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 54.409999999999997 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 65.420000000000002 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.230000000000004 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 63.219999999999999 112.358 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 60.0 112.698 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 61.439999999999998 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.485 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.400000000000006 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.239999999999995 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 73.129999999999995 110.9 -175.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 64.400000000000006 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 64.120000000000005 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.229999999999997 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.140000000000001 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 53.539999999999999 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.420000000000002 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.493 ' CA ' HD11 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.329999999999998 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 70.140000000000001 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 64.150000000000006 109.252 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.47 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.239999999999995 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.702 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 63.310000000000002 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 74.340000000000003 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 70.200000000000003 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.516 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 73.549999999999997 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 64.150000000000006 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 71.519999999999996 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.430000000000007 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.120000000000005 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.400000000000006 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.465 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 63.240000000000002 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.55 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 71.129999999999995 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 71.400000000000006 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.685 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 54.109999999999999 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.319999999999993 111.146 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.239999999999995 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.474 HG23 HG22 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 54.520000000000003 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.439999999999998 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.350000000000001 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 73.209999999999994 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.310000000000002 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 33.109999999999999 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.510000000000005 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 40.439999999999998 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 72.430000000000007 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.409999999999997 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.636 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 54.530000000000001 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.465 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.030000000000001 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 51.450000000000003 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 72.120000000000005 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.239999999999995 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.636 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.319999999999993 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.140000000000001 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 71.510000000000005 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.704 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 74.0 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.209999999999994 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.109999999999999 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.530000000000001 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.030000000000001 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.310000000000002 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 121.013 0.435 . . . . 74.409999999999997 110.034 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -99.4 90.98 4.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.439 0.638 . . . . 75.420000000000002 109.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -89.0 176.0 7.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.206 -0.906 . . . . 60.539999999999999 110.999 -173.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? -70.34 -12.09 61.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.319999999999993 110.721 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.230000000000004 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.310000000000002 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.507 HD22 ' H ' ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.120000000000005 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.120000000000005 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 51.229999999999997 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 62.039999999999999 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.420000000000002 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.299999999999997 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.140000000000001 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.239999999999995 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.584 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.239999999999995 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 74.530000000000001 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 63.219999999999999 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.412 HG22 HG22 ' A' ' 21' ' ' THR . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 71.129999999999995 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.434 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 70.430000000000007 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 23' ' ' SER . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.239999999999995 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 54.409999999999997 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.239999999999995 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 71.25 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 72.129999999999995 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.319999999999993 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 35.020000000000003 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 61.119999999999997 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.48 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.400000000000006 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.593 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 72.109999999999999 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.806 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 54.140000000000001 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.109999999999999 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.239999999999995 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.593 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 5.9 tp-100 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.540000000000006 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.049999999999997 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 74.219999999999999 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.531 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.010000000000005 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.329999999999998 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.566 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.219999999999999 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.571 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.510000000000005 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.040000000000006 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 63.140000000000001 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 70.200000000000003 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.806 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 62.119999999999997 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.806 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 43.340000000000003 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.310000000000002 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.439999999999998 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.310000000000002 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 52.350000000000001 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.439999999999998 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.010000000000005 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 51.310000000000002 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HB3' HG23 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 64.140000000000001 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.1 t30 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.099999999999994 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.530000000000001 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.409999999999997 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.240000000000002 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.319999999999993 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.540000000000006 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.549999999999997 109.993 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.549999999999997 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 73.129999999999995 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.400000000000006 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.525 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.209999999999994 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 70.030000000000001 109.459 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.329999999999998 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.049999999999997 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.916 HD13 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 65.340000000000003 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 55.240000000000002 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 71.230000000000004 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.230000000000004 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.420000000000002 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 54.32 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.441 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.530000000000001 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.916 HG12 HD13 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 61.329999999999998 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 54.009999999999998 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.140000000000001 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.525 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.430000000000007 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 53.299999999999997 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 73.540000000000006 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.430000000000007 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.219999999999999 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.430000000000007 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 63.020000000000003 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.606 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 72.430000000000007 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 41.310000000000002 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.439999999999998 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.510000000000005 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.529 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.099999999999994 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 55.299999999999997 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.420000000000002 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.049999999999997 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.319999999999993 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 54.409999999999997 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.219999999999999 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 61.020000000000003 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.109999999999999 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 31.239999999999998 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 70.129999999999995 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 71.310000000000002 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.019999999999996 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.441 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.140000000000001 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 71.310000000000002 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 65.439999999999998 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 72.450000000000003 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.519999999999996 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.209999999999994 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 65.5 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.486 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.319999999999993 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 63.200000000000003 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 70.5 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 70.439999999999998 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.48 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.0 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.310000000000002 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.557 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 63.240000000000002 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 60.25 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.109999999999999 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.806 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 63.32 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 109.862 -0.421 . . . . 70.219999999999999 109.862 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -105.87 106.73 17.37 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.13 -0.322 . . . . 62.439999999999998 110.13 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -119.11 100.69 7.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.015 0.436 . . . . 72.400000000000006 112.167 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp -72.44 -19.3 61.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.622 -0.881 . . . . 73.409999999999997 108.622 171.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 70.010000000000005 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.679 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.409999999999997 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 72.239999999999995 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.340000000000003 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 63.43 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.427 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.040000000000006 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 62.140000000000001 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 51.450000000000003 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 64.510000000000005 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.476 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.239999999999995 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.788 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.340000000000003 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.788 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 71.109999999999999 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.010000000000005 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.140000000000001 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 54.299999999999997 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.786 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 44.210000000000001 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.399999999999999 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.476 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.049999999999997 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 65.109999999999999 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.219999999999999 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.310000000000002 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.537 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 63.32 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 62.509999999999998 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 71.430000000000007 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.702 ' H ' ' HD2' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 65.299999999999997 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 34.219999999999999 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.340000000000003 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 64.310000000000002 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.55 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.239999999999995 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 50.140000000000001 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 64.120000000000005 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.499 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 73.299999999999997 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.532 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.420000000000002 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 64.430000000000007 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.786 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.546 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 61.149999999999999 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.239999999999995 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 53.149999999999999 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.129999999999995 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.109999999999999 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.230000000000004 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.25 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.209999999999994 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.535 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.319999999999993 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 71.239999999999995 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.340000000000003 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.140000000000001 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 72.540000000000006 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 71.230000000000004 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 64.340000000000003 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.340000000000003 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 53.409999999999997 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.319999999999993 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.540000000000006 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.109999999999999 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.340000000000003 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.434 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.019999999999996 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 73.519999999999996 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.491 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 64.040000000000006 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 71.409999999999997 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.239999999999995 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.299999999999997 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.546 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.209999999999994 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.510000000000005 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 52.530000000000001 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 71.239999999999995 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 74.120000000000005 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.491 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 70.0 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.129999999999995 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.472 ' O ' HG12 ' A' ' 35' ' ' VAL . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 63.299999999999997 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 64.439999999999998 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 71.329999999999998 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.584 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 78.7 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 64.150000000000006 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.129999999999995 110.556 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.329999999999998 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 64.209999999999994 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.030000000000001 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.416 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 42.329999999999998 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.450000000000003 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 61.030000000000001 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.698 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.230000000000004 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.349999999999994 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.535 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 72.239999999999995 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.510000000000005 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.598 ' HA ' HG22 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.120000000000005 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.140000000000001 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 43.530000000000001 111.397 174.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 71.219999999999999 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 73.430000000000007 110.046 176.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 54.009999999999998 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.420000000000002 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.319999999999993 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.530000000000001 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.530000000000001 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.329999999999998 109.168 -177.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.427 ' HB ' HG23 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 54.399999999999999 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.409999999999997 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.416 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 74.510000000000005 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.409999999999997 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 63.43 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.319999999999993 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 71.439999999999998 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 73.109999999999999 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.019999999999996 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 72.019999999999996 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.129999999999995 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 72.420000000000002 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.530000000000001 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 51.149999999999999 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.219999999999999 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 72.209999999999994 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.067 -0.346 . . . . 74.420000000000002 110.067 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -118.45 106.17 12.43 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.968 0.414 . . . . 75.349999999999994 110.408 175.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.514 ' OE2' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -93.13 164.94 13.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.813 -0.63 . . . . 72.409999999999997 109.333 174.249 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -66.65 -24.48 66.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.149 -0.22 . . . . 74.430000000000007 111.252 -176.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.519999999999996 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.514 ' HB2' ' OE2' ' A' ' 3' ' ' GLU . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.209999999999994 109.894 172.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 62.140000000000001 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 72.140000000000001 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.439999999999998 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 61.0 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.109999999999999 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.230000000000004 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.420000000000002 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.569 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.340000000000003 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.430000000000007 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 19' ' ' VAL . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 63.009999999999998 110.015 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.459 ' N ' HG22 ' A' ' 18' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 72.230000000000004 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 73.530000000000001 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.437 HG22 ' OE1' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.049999999999997 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.450000000000003 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.579 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.310000000000002 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 64.0 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 70.299999999999997 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HZ2' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.099999999999994 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.420000000000002 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 53.43 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 71.319999999999993 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 65.129999999999995 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.528 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.030000000000001 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.528 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 54.329999999999998 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.120000000000005 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.439999999999998 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 80' ' ' MET . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.310000000000002 111.239 -176.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.319999999999993 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.019999999999996 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.319999999999993 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.120000000000005 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.432 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.240000000000002 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.775 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.120000000000005 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.535 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.010000000000005 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 64.230000000000004 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 61.539999999999999 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 40.020000000000003 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.130000000000003 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.200000000000003 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.519999999999996 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.430000000000007 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.109999999999999 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 65.239999999999995 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.420000000000002 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.040000000000006 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 65.3 t30 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.530000000000001 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.450000000000003 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.430000000000007 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.439 ' HG3' HD13 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.219999999999999 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.549999999999997 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.329999999999998 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CG ' ' H ' ' A' ' 67' ' ' MET . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.140000000000001 109.592 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 62.009999999999998 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.530000000000001 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.578 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.200000000000003 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.432 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.239999999999995 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 71.0 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.428 ' H ' ' CG ' ' A' ' 61' ' ' GLU . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.150000000000006 110.339 -176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 72.200000000000003 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.319999999999993 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.0 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 70.349999999999994 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.010000000000005 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.340000000000003 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.120000000000005 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.530000000000001 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.150000000000006 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.471 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.540000000000006 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.421 ' HB2' ' HB ' ' A' ' 35' ' ' VAL . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 72.209999999999994 112.074 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.120000000000005 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.519999999999996 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 62.229999999999997 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 87.3 mm-40 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 71.109999999999999 112.447 -174.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 73.439999999999998 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.219999999999999 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.578 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.530000000000001 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.423 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.209999999999994 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 71.510000000000005 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 70.400000000000006 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 70.239999999999995 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.543 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 70.450000000000003 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 62.299999999999997 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 63.219999999999999 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.239999999999995 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 64.340000000000003 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.349999999999994 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 54.210000000000001 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.420000000000002 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 54.200000000000003 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 52.229999999999997 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 72.530000000000001 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.669 ' HB2' HD11 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.299999999999997 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.140000000000001 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.010000000000005 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 63.009999999999998 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.542 HD22 ' HA ' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 61.25 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 63.329999999999998 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.340000000000003 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.450000000000003 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.450000000000003 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HA ' HD22 ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 54.420000000000002 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 64.209999999999994 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.129999999999995 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 73.030000000000001 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 73.109999999999999 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.329999999999998 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 70.239999999999995 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 72.340000000000003 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 71.140000000000001 110.013 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -102.98 164.71 11.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.969 -0.559 . . . . 73.5 110.669 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.28 152.88 51.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.034 -0.53 . . . . 65.510000000000005 110.279 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt -70.64 -20.92 62.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.0 -0.546 . . . . 75.150000000000006 111.37 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.120000000000005 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.688 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.239999999999995 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.230000000000004 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 71.340000000000003 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.439999999999998 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 65.140000000000001 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.433 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.430000000000007 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.482 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.540000000000006 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 70.340000000000003 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.340000000000003 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.435 ' HE2' ' HB1' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 62.520000000000003 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 62.119999999999997 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.409999999999997 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.405 HG22 ' HG3' ' A' ' 24' ' ' GLU . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 63.32 110.617 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 71.299999999999997 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 64.120000000000005 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 50.119999999999997 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.732 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.25 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HG3' HG22 ' A' ' 18' ' ' THR . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 109.204 173.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.972 HD23 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.129999999999995 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.435 ' HB1' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 61.520000000000003 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 71.430000000000007 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.506 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.430000000000007 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 70.439999999999998 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.599 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 72.239999999999995 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.319999999999993 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 15.3 mm100 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 72.25 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.299999999999997 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.539 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.409999999999997 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.219999999999999 108.415 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.482 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.150000000000006 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.51 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.200000000000003 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.732 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 53.420000000000002 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.409999999999997 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 64.129999999999995 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 52.299999999999997 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.540000000000006 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.409999999999997 110.077 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 50.109999999999999 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 65.140000000000001 110.277 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.019999999999996 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.422 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 61.340000000000003 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 51.219999999999999 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.340000000000003 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 74.420000000000002 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 64.209999999999994 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.209999999999994 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 41.4 t30 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 72.040000000000006 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.549999999999997 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.219999999999999 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.329999999999998 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.150000000000006 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 72.430000000000007 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.430000000000007 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.109999999999999 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 40.25 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 54.109999999999999 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.439999999999998 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 62.109999999999999 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.299999999999997 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.566 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 72.530000000000001 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 64.340000000000003 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 61.210000000000001 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 70.510000000000005 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.129999999999995 107.121 167.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 55.439999999999998 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.420000000000002 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.402 HD13 ' HA ' ' A' ' 40' ' ' GLN . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 71.319999999999993 110.222 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.400000000000006 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.566 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.450000000000003 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.219999999999999 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.688 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.439999999999998 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.430000000000007 108.453 170.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 64.310000000000002 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' LEU . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 64.400000000000006 107.966 175.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 55.420000000000002 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.409999999999997 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 83' ' ' LEU . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.340000000000003 109.41 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.627 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.409999999999997 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.409999999999997 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.310000000000002 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.010000000000005 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.472 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.299999999999997 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 54.329999999999998 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.240000000000002 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.972 HD11 HD23 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.530000000000001 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 73.219999999999999 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.536 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 71.150000000000006 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 53.100000000000001 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.209999999999994 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 74.230000000000004 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 61.140000000000001 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.210000000000001 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.329999999999998 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.510000000000005 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.329999999999998 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 51.530000000000001 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.239999999999995 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 62.520000000000003 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.510000000000005 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.129999999999995 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 73.530000000000001 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.637 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.140000000000001 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 53.130000000000003 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 72.219999999999999 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 70.230000000000004 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.230000000000004 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.450000000000003 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.415 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 72.129999999999995 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.439999999999998 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.510000000000005 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.273 -0.269 . . . . 71.239999999999995 110.273 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 56.71 27.83 13.27 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.521 0.677 . . . . 73.439999999999998 111.108 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.425 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 6.7 pt-20 -90.05 33.53 0.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.229 -0.896 . . . . 71.219999999999999 110.321 -177.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm -58.52 -32.18 68.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 75.519999999999996 111.753 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.416 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.109999999999999 111.457 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.478 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 70.439999999999998 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 44.350000000000001 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 65.420000000000002 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.77 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 64.310000000000002 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 10' ' ' LEU . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.099999999999994 108.823 176.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.407 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.200000000000003 109.931 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.340000000000003 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.209999999999994 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 70.150000000000006 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 71.409999999999997 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.514 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.239999999999995 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.010000000000005 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.465 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 24.239999999999998 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.998 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.209999999999994 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.998 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.450000000000003 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.099999999999994 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 42.439999999999998 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.299999999999997 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 65.219999999999999 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.140000000000001 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.230000000000004 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.540000000000006 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.219999999999999 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.404 HG22 ' HG3' ' A' ' 117' ' ' GLN . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 64.510000000000005 110.574 -176.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.540000000000006 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.039999999999999 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 54.549999999999997 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 41.420000000000002 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.76 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.420000000000002 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 64.5 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 11' ' ' SER . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.219999999999999 110.077 -178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.529 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.549999999999997 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.624 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 61.340000000000003 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.512 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.329999999999998 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.349999999999994 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 45.219999999999999 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.420000000000002 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.450000000000003 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.564 HD13 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 71.010000000000005 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.340000000000003 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 62.539999999999999 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.340000000000003 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.409999999999997 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 72.540000000000006 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.099999999999994 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 64.420000000000002 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 53.420000000000002 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.420000000000002 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 63.439999999999998 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 63.240000000000002 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 73.400000000000006 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 64.049999999999997 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 72.340000000000003 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.230000000000004 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.230000000000004 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.109999999999999 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.310000000000002 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.209999999999994 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.478 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 54.219999999999999 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.210000000000001 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.040000000000006 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.553 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.430000000000007 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.519999999999996 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.893 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 73.430000000000007 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 73.129999999999995 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 72.109999999999999 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 62.229999999999997 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 70.0 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.553 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.239999999999995 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 70.329999999999998 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.329999999999998 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.77 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.400000000000006 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.099999999999994 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.76 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 65.420000000000002 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.049999999999997 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.209999999999994 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.109999999999999 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 70.219999999999999 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 72.239999999999995 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.150000000000006 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.219999999999999 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 62.409999999999997 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.200000000000003 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.299999999999997 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.487 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 72.329999999999998 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.349999999999994 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.510000000000005 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.430000000000007 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.430000000000007 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 43.109999999999999 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.971 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.099999999999994 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.109999999999999 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.150000000000006 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 62.32 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.200000000000003 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 63.229999999999997 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 70.219999999999999 109.339 -177.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.299999999999997 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.409999999999997 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 65.140000000000001 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.030000000000001 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.219999999999999 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.109999999999999 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.586 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.519999999999996 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 73.319999999999993 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.529 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 71.540000000000006 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 119' ' ' GLU . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 65.329999999999998 110.735 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.200000000000003 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.130000000000003 111.725 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 63.32 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.540000000000006 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 53.32 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.120000000000005 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.139 -0.319 . . . . 74.510000000000005 110.139 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.15 90.89 8.0 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 61.109999999999999 109.455 172.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.32 109.42 18.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.433 -0.803 . . . . 75.129999999999995 110.644 -174.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.1 -36.39 83.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.200000000000003 110.886 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.239999999999995 110.671 -178.62 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 77' ' ' GLU . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.319999999999993 110.415 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 73.019999999999996 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 61.25 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.450000000000003 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 61.219999999999999 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.349999999999994 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.604 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.530000000000001 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.450000000000003 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.450000000000003 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 71.409999999999997 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 61.310000000000002 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.628 HG22 HG22 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 73.120000000000005 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 54.509999999999998 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.628 HG22 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.219999999999999 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.319999999999993 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.471 ' H ' HG23 ' A' ' 21' ' ' THR . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 60.200000000000003 110.003 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HG2' ' HA ' ' A' ' 15' ' ' LYS . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.109999999999999 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.487 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.129999999999995 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 72.209999999999994 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 52.509999999999998 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 64.140000000000001 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 65.420000000000002 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 73.340000000000003 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.310000000000002 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.711 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 19.6 mm-40 -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.519999999999996 110.036 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.150000000000006 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.310000000000002 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.230000000000004 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 61.549999999999997 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.120000000000005 110.646 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 71.010000000000005 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.209999999999994 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.49 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.519999999999996 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.509 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.230000000000004 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.129999999999995 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 72.409999999999997 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.510000000000005 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.519999999999996 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.230000000000004 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 71.239999999999995 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 40.140000000000001 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.400000000000006 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.109999999999999 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 71.439999999999998 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 62.409999999999997 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.049999999999997 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 44.219999999999999 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.439999999999998 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 64.030000000000001 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 71.230000000000004 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HG3' ' HD2' ' A' ' 66' ' ' LYS . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 65.340000000000003 109.715 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.401 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 64.430000000000007 113.26 -173.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.229999999999997 113.586 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 1.007 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 41.329999999999998 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 72.329999999999998 109.458 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.403 ' HD2' ' HG3' ' A' ' 61' ' ' GLU . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.239999999999995 109.65 176.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.409999999999997 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.219999999999999 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.150000000000006 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 74.140000000000001 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.815 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 62.210000000000001 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.420000000000002 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.230000000000004 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 61.420000000000002 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 63.329999999999998 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.329999999999998 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE1' ' HB3' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.329999999999998 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 67' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 64.519999999999996 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 54.420000000000002 110.875 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.602 ' HG3' ' N ' ' A' ' 82' ' ' LYS . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.329999999999998 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.602 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 52.039999999999999 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 1.007 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 64.049999999999997 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.319999999999993 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 71.340000000000003 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.239999999999995 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.499 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.310000000000002 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.492 ' HA2' HG23 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.399999999999999 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 51.130000000000003 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 64.120000000000005 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.783 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.129999999999995 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 71.319999999999993 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.329999999999998 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.099999999999994 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HB3' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.409999999999997 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.530000000000001 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 33.450000000000003 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 63.520000000000003 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 63.200000000000003 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 62.509999999999998 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.030000000000001 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 73.040000000000006 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.519999999999996 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 64.040000000000006 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 70.209999999999994 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.319999999999993 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.200000000000003 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.492 HG23 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.340000000000003 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.039999999999999 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 34.200000000000003 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.400000000000006 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.209999999999994 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 71.120000000000005 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.140000000000001 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 71.420000000000002 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 31' ' ' GLU . 45.0 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 73.319999999999993 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 63.409999999999997 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.230000000000004 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 60.130000000000003 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.150000000000006 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 62.409999999999997 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.72 0.295 . . . . 74.109999999999999 110.3 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 1.9 pm0 -77.12 162.52 27.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.167 0.508 . . . . 74.510000000000005 111.007 179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.433 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -71.3 123.11 21.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.51 -0.768 . . . . 74.420000000000002 110.71 -174.875 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm -79.5 -37.56 36.43 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.329999999999998 112.593 -177.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.433 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 62.43 112.16 -170.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 74.25 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 7' ' ' LEU . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 53.420000000000002 110.5 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.409999999999997 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.329999999999998 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.310000000000002 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.563 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.009999999999998 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.340000000000003 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.120000000000005 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.430000000000007 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.72 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 63.140000000000001 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.439999999999998 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 53.439999999999998 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG22 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.430000000000007 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.506 ' H ' HG22 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 61.520000000000003 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 63.149999999999999 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.409999999999997 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.310000000000002 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.598 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 71.439999999999998 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.310000000000002 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 53.409999999999997 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 51.009999999999998 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 63.219999999999999 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 72.319999999999993 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 121' ' ' GLU . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 64.120000000000005 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.319999999999993 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 55.4 mm-40 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 73.510000000000005 112.188 -162.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 65.200000000000003 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.563 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 65.349999999999994 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.595 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.549999999999997 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 72.129999999999995 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.514 ' HB3' HD22 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.209999999999994 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.409999999999997 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 73.319999999999993 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 62.520000000000003 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.209999999999994 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 70.439999999999998 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.030000000000001 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 62.210000000000001 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.349999999999994 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.420000000000002 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.463 ' CG ' ' HB3' ' A' ' 96' ' ' GLN . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 63.43 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 73.409999999999997 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.409999999999997 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.549 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.109999999999999 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.608 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.319999999999993 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.430000000000007 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 62.109999999999999 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.409999999999997 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.109999999999999 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 63.450000000000003 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 71.549999999999997 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 73.420000000000002 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 64.439999999999998 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.129999999999995 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 64.329999999999998 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.150000000000006 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.481 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 41.520000000000003 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 63.439999999999998 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 64.310000000000002 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.239999999999995 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.299999999999997 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.219999999999999 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 65.409999999999997 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.430000000000007 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.509999999999998 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.420000000000002 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 64.430000000000007 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 72.129999999999995 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.442 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 63.420000000000002 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 71.049999999999997 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.65 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.340000000000003 109.749 176.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 53.030000000000001 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.463 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 64.540000000000006 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.310000000000002 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.51 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.329999999999998 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 74.519999999999996 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 74.329999999999998 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.439999999999998 109.882 176.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.608 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.109999999999999 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.040000000000006 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.53 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 51.329999999999998 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.582 ' HA ' HG22 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 52.130000000000003 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.349999999999994 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 63.509999999999998 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 74.349999999999994 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 52.509999999999998 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.329999999999998 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.413 ' O ' ' HB ' ' A' ' 95' ' ' ILE . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.140000000000001 111.975 175.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 64.409999999999997 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.598 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.120000000000005 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 65.420000000000002 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.510000000000005 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.562 HG13 HG11 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.430000000000007 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 64.430000000000007 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 63.119999999999997 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.423 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.299999999999997 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.010000000000005 111.35 -176.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.562 HG11 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 71.200000000000003 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.019999999999996 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.329999999999998 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 72.319999999999993 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 64.340000000000003 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.53 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 65.230000000000004 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.409999999999997 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 33.32 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.478 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.450000000000003 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 55.420000000000002 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 110.206 -0.294 . . . . 64.239999999999995 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -73.5 135.31 44.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.449 -0.575 . . . . 64.430000000000007 109.449 175.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.616 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 6.9 tt0 -80.51 118.73 22.37 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.569 -0.741 . . . . 72.120000000000005 111.838 -172.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -77.62 -12.56 59.98 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.233 -0.439 . . . . 54.539999999999999 112.031 177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.616 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 62.140000000000001 111.202 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 71.099999999999994 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.519999999999996 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.230000000000004 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 64.5 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.229999999999997 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.019999999999996 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.010000000000005 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 62.100000000000001 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.120000000000005 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 54.130000000000003 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 70.530000000000001 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.439999999999998 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 73.439999999999998 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.471 ' O ' HG13 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 54.340000000000003 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 74.040000000000006 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 63.310000000000002 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 65.099999999999994 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.828 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 72.530000000000001 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.493 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 61.329999999999998 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 52.409999999999997 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.584 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 72.109999999999999 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.439999999999998 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.129999999999995 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.631 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.239999999999995 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.631 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.439999999999998 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.430000000000007 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 53.9 mm-40 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 62.530000000000001 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 63.030000000000001 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 64.019999999999996 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.540000000000006 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.427 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.409999999999997 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.505 ' HB3' HD22 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 72.310000000000002 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.474 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.400000000000006 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 72.25 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.601 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 64.310000000000002 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.239999999999995 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.462 ' H ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 54.240000000000002 109.381 175.08 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 53.119999999999997 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.200000000000003 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.230000000000004 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.010000000000005 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 62.399999999999999 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 70.109999999999999 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 64.310000000000002 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.512 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 61.32 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 62.240000000000002 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 73.099999999999994 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.7 t30 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.129999999999995 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 65.120000000000005 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 71.450000000000003 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.349999999999994 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.150000000000006 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.120000000000005 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.310000000000002 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.310000000000002 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 50.340000000000003 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.329999999999998 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 64.409999999999997 110.59 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 70.340000000000003 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 111.162 -175.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.430000000000007 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 72.540000000000006 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.510000000000005 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.129999999999995 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 43.25 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 65.340000000000003 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 60.530000000000001 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 54.439999999999998 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.019999999999996 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 61.140000000000001 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 72.430000000000007 109.32 177.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.230000000000004 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.099999999999994 110.766 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.310000000000002 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.310000000000002 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.239999999999995 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.529 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 65.310000000000002 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.529 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 62.340000000000003 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 63.32 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.451 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 44.340000000000003 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 63.119999999999997 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.439999999999998 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.310000000000002 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.219999999999999 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.686 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.010000000000005 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 73.450000000000003 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.209999999999994 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 64.540000000000006 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.140000000000001 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.614 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.409999999999997 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 72.439999999999998 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 55.109999999999999 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.614 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 73.109999999999999 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 64.0 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.299999999999997 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 72.450000000000003 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.828 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 64.409999999999997 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.409999999999997 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.409999999999997 109.112 -175.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 61.439999999999998 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 64.120000000000005 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.030000000000001 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 62.109999999999999 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.430000000000007 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.150000000000006 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.56 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 64.150000000000006 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.129999999999995 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.040000000000006 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 71.230000000000004 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.55 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.219999999999999 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.209999999999994 111.687 176.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.519999999999996 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 61.329999999999998 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.040000000000006 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.209999999999994 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 109.895 -0.409 . . . . 72.439999999999998 109.895 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -108.34 68.85 0.71 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 109.89 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.85 136.96 55.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.737 -0.665 . . . . 72.319999999999993 110.122 178.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -64.55 -21.61 66.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.688 0.28 . . . . 70.219999999999999 111.058 -174.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.540000000000006 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 64.530000000000001 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 54.229999999999997 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.310000000000002 110.396 174.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 65.239999999999995 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.319999999999993 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.109999999999999 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 74.439999999999998 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.030000000000001 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 73.409999999999997 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.607 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 55.009999999999998 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 51.009999999999998 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.400000000000006 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.787 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.340000000000003 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.787 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.519999999999996 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.455 ' H ' HG23 ' A' ' 19' ' ' VAL . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.140000000000001 111.087 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.8 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 62.509999999999998 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.340000000000003 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.219999999999999 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.579 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 71.129999999999995 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 63.130000000000003 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 63.509999999999998 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.510000000000005 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 45.219999999999999 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.603 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.530000000000001 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 55.240000000000002 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 65.25 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.466 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.340000000000003 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.450000000000003 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.591 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.129999999999995 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.483 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.120000000000005 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 64.349999999999994 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 52.539999999999999 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 71.030000000000001 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 73.439999999999998 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.319999999999993 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.8 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 73.0 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.588 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 41.409999999999997 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.200000000000003 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 65.049999999999997 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 64.219999999999999 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 64.540000000000006 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.200000000000003 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.040000000000006 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.423 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.430000000000007 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 62.340000000000003 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.542 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.646 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.340000000000003 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.039999999999999 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.549999999999997 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.439999999999998 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 73.010000000000005 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.109999999999999 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.150000000000006 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.329999999999998 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.140000000000001 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.329999999999998 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.812 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 73.140000000000001 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.481 ' CD1' ' HE2' ' A' ' 80' ' ' MET . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 111.029 -170.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.219999999999999 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.299999999999997 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 60.420000000000002 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 70.230000000000004 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 62.399999999999999 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.340000000000003 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.120000000000005 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 55.25 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 64.010000000000005 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.545 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 64.400000000000006 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.558 ' HG2' HD21 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.430000000000007 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.553 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 52.149999999999999 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 62.200000000000003 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.591 ' HB3' ' HB ' ' A' ' 35' ' ' VAL . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.219999999999999 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 61.229999999999997 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.466 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.010000000000005 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.812 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 61.299999999999997 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 55.039999999999999 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.210000000000001 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.319999999999993 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 74.329999999999998 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.461 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.219999999999999 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 32.020000000000003 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.030000000000001 109.227 173.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.689 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 55.229999999999997 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.542 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.010000000000005 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.019999999999996 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 45.399999999999999 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.030000000000001 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.340000000000003 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.510000000000005 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.109999999999999 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 54.030000000000001 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 73.540000000000006 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.209999999999994 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.099999999999994 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.409999999999997 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.450000000000003 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 50.229999999999997 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 71.439999999999998 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.424 HD22 ' HB2' ' A' ' 113' ' ' TYR . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.310000000000002 110.297 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.461 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 71.329999999999998 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 53.350000000000001 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.661 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.519999999999996 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 72.109999999999999 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.424 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.030000000000001 112.437 -175.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 54.310000000000002 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.129999999999995 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.401 ' HG ' HD11 ' A' ' 106' ' ' LEU . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 64.549999999999997 110.497 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 62.130000000000003 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 73.329999999999998 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.230000000000004 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.420000000000002 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.430000000000007 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.420000000000002 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.363 -0.606 . . . . 75.129999999999995 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -111.05 132.26 54.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.325 -0.398 . . . . 73.540000000000006 111.055 -173.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -78.27 102.78 7.82 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.833 -1.173 . . . . 72.430000000000007 107.833 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm -67.91 -32.09 72.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.423 -0.808 . . . . 72.299999999999997 112.815 -162.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 73.409999999999997 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 50.520000000000003 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 72.310000000000002 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.209999999999994 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' HB2' ' HD1' ' A' ' 79' ' ' PHE . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.200000000000003 110.99 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.519999999999996 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 61.200000000000003 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.129999999999995 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 62.509999999999998 109.715 178.825 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.430000000000007 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 72.400000000000006 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 73.209999999999994 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.319999999999993 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 65.420000000000002 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 70.019999999999996 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.150000000000006 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.439999999999998 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.340000000000003 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.239999999999995 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 70.099999999999994 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 72.230000000000004 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.130000000000003 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.209999999999994 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.299999999999997 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 72.319999999999993 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 44.229999999999997 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.459 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 62.43 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.430000000000007 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.329999999999998 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 65.9 mm-40 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.340000000000003 111.984 -169.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.549999999999997 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.595 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 73.329999999999998 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' HD21 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 71.099999999999994 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.439999999999998 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 72.409999999999997 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 72.140000000000001 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.420000000000002 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.239999999999995 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.519999999999996 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 64.310000000000002 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.43 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 60.509999999999998 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 51.039999999999999 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 64.25 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.439999999999998 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 73.200000000000003 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 94' ' ' GLN . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.130000000000003 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.319999999999993 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 70.209999999999994 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.310000000000002 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.0 t30 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 62.310000000000002 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 72.319999999999993 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.510000000000005 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.140000000000001 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.537 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 54.43 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.409999999999997 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 71.439999999999998 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.040000000000006 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.340000000000003 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.408 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.530000000000001 109.9 -175.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.646 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.530000000000001 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.099999999999994 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.049999999999997 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.409999999999997 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.43 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.350000000000001 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.010000000000005 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.030000000000001 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 71.109999999999999 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.576 ' CA ' HD22 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.299999999999997 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.530000000000001 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.427 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 70.310000000000002 109.125 172.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 64.430000000000007 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.239999999999995 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.463 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.549999999999997 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.486 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.510000000000005 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 61.25 110.699 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.498 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 63.439999999999998 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.875 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.109999999999999 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.530000000000001 109.735 178.966 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.875 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.219999999999999 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.340000000000003 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.605 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.230000000000004 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.299999999999997 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 71.230000000000004 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.591 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.329999999999998 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 73.329999999999998 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.409999999999997 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 74.540000000000006 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.703 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.010000000000005 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 64.510000000000005 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.439999999999998 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.519999999999996 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.239999999999995 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 22.43 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 47.3 p-80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.450000000000003 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.150000000000006 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 63.219999999999999 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.417 ' HG ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 61.32 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.450000000000003 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 60.140000000000001 110.287 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.605 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 71.219999999999999 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.150000000000006 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.400000000000006 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.409999999999997 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.631 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.219999999999999 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.349999999999994 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 61.130000000000003 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 116' ' ' LEU . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 61.130000000000003 110.699 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.420000000000002 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.040000000000006 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.424 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 62.119999999999997 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.230000000000004 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 60.43 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.420000000000002 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.778 0.323 . . . . 72.340000000000003 110.497 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.403 ' HG3' ' HD3' ' A' ' 6' ' ' ARG . 43.8 tt0 -106.57 90.25 3.28 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.118 0.485 . . . . 74.049999999999997 110.051 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.422 ' OE2' ' HB3' ' A' ' 5' ' ' LYS . 9.4 pt-20 -77.1 155.39 32.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.933 -0.576 . . . . 63.350000000000001 109.699 175.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -61.28 -26.98 68.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.882 0.372 . . . . 74.140000000000001 110.469 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 74.310000000000002 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.403 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.409999999999997 109.124 172.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' HD12 ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 64.219999999999999 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 63.219999999999999 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.25 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.310000000000002 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.468 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 61.549999999999997 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 63.43 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 64.140000000000001 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.409999999999997 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.562 ' HB2' HG23 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.329999999999998 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.614 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.420000000000002 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.109999999999999 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.230000000000004 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.561 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.400000000000006 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 62.119999999999997 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 61.0 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.723 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 64.030000000000001 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.439999999999998 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 71.120000000000005 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.140000000000001 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.429 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.549999999999997 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 71.040000000000006 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.409999999999997 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.129999999999995 109.019 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 63.340000000000003 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 73.340000000000003 110.013 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 64.129999999999995 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.150000000000006 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.140000000000001 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.540000000000006 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.549999999999997 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.429 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 73.319999999999993 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.562 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 52.409999999999997 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 61.520000000000003 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.450000000000003 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.604 HD11 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.510000000000005 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.239999999999995 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 60.509999999999998 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.129999999999995 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.450000000000003 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.25 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 54.539999999999999 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 74.519999999999996 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.349999999999994 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 73.25 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.435 ' HB3' HG23 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 74.150000000000006 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 60.5 t30 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 71.450000000000003 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 63.310000000000002 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 71.530000000000001 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 63.130000000000003 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.435 HG23 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.010000000000005 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.030000000000001 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 72.340000000000003 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 43.450000000000003 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.430000000000007 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.099999999999994 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.403 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.120000000000005 109.182 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.299999999999997 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.409999999999997 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 73.430000000000007 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.409999999999997 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.010000000000005 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.604 ' HA2' HD11 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 42.340000000000003 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.409999999999997 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.562 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 63.420000000000002 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.010000000000005 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.518 ' HG2' ' HG3' ' A' ' 80' ' ' MET . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.310000000000002 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.518 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.239999999999995 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.519999999999996 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 63.420000000000002 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.466 ' H ' ' CB ' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 54.109999999999999 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 73.150000000000006 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.129999999999995 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.439999999999998 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.319999999999993 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.509 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.200000000000003 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.200000000000003 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.109999999999999 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.487 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.430000000000007 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.340000000000003 110.508 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.109999999999999 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.427 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.120000000000005 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.140000000000001 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.439999999999998 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 61.210000000000001 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.120000000000005 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.429 ' HB2' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 65.420000000000002 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.010000000000005 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.230000000000004 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.349999999999994 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.150000000000006 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 71.430000000000007 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 63.340000000000003 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 54.039999999999999 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 61.310000000000002 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.509 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 72.230000000000004 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.100000000000001 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.510000000000005 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 64.540000000000006 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.531 ' HA ' HD22 ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.030000000000001 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.687 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 64.019999999999996 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 73.549999999999997 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.340000000000003 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.605 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.549999999999997 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.219999999999999 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 70.310000000000002 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 34.0 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 70.25 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.430000000000007 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.898 0.38 . . . . 74.219999999999999 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -99.35 148.24 24.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.081 -0.508 . . . . 72.519999999999996 110.275 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -62.67 109.03 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.222 -0.444 . . . . 72.310000000000002 111.13 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -62.16 -19.16 62.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 63.509999999999998 110.605 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 72.310000000000002 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 73.430000000000007 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 72.340000000000003 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 55.350000000000001 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.040000000000006 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.439999999999998 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.239999999999995 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.430000000000007 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 61.409999999999997 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 65.340000000000003 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.507 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.430000000000007 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.735 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 62.25 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.735 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 53.43 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 64.319999999999993 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.428 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.400000000000006 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.400000000000006 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.219999999999999 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 63.149999999999999 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 55.32 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 40' ' ' GLN . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.150000000000006 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.329999999999998 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.540000000000006 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.109999999999999 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.230000000000004 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.458 ' H ' HD12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 53.009999999999998 110.384 -175.702 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 71.420000000000002 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.818 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.349999999999994 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 72.349999999999994 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.400000000000006 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 65.140000000000001 110.292 179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.439999999999998 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 70.409999999999997 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 73.430000000000007 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.574 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.543 ' HG2' ' HB3' ' A' ' 24' ' ' GLU . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.439999999999998 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.109999999999999 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.120000000000005 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.540000000000006 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.409999999999997 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 71.530000000000001 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.439999999999998 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 53.039999999999999 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 43.119999999999997 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 72.209999999999994 110.108 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.594 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 54.450000000000003 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.340000000000003 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 72.140000000000001 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.239999999999995 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.492 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 73.030000000000001 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.219999999999999 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 72.140000000000001 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 73.319999999999993 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.230000000000004 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.492 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.230000000000004 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.150000000000006 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 65' ' ' TYR . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 71.299999999999997 110.49 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.209999999999994 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.140000000000001 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 71.140000000000001 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.431 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 72.150000000000006 111.26 -176.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 73.109999999999999 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.421 ' HB2' ' HE3' ' A' ' 78' ' ' MET . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.299999999999997 111.479 -169.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.219999999999999 109.702 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 62.210000000000001 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.32 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.530000000000001 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 63.200000000000003 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.310000000000002 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 34.350000000000001 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 73.319999999999993 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.574 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 71.230000000000004 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.549999999999997 110.614 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.544 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.030000000000001 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.040000000000006 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.540000000000006 112.598 -172.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.569 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.310000000000002 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 73.230000000000004 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 73.030000000000001 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.523 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.150000000000006 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.200000000000003 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.523 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 55.329999999999998 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.540000000000006 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.450000000000003 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.209999999999994 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 72.239999999999995 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.310000000000002 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 65.129999999999995 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.495 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 61.520000000000003 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.010000000000005 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.594 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.439999999999998 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.150000000000006 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.150000000000006 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.401 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 64.010000000000005 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 43.32 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.230000000000004 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.129999999999995 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 50.509999999999998 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.230000000000004 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.446 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.319999999999993 108.968 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.109999999999999 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 55.229999999999997 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.540000000000006 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.329999999999998 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.409999999999997 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 73.230000000000004 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 64.109999999999999 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.319999999999993 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.200000000000003 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 29' ' ' ILE . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 63.409999999999997 110.513 177.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.349999999999994 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.310000000000002 111.489 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.319999999999993 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 50.0 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.818 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 61.439999999999998 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 50.020000000000003 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.706 -0.479 . . . . 73.219999999999999 109.706 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -122.63 138.11 54.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.449 -0.341 . . . . 75.519999999999996 110.131 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 80.1 mt-10 -81.45 89.56 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.901 0.381 . . . . 72.219999999999999 110.09 177.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt -63.09 -30.05 71.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 70.420000000000002 110.485 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.439999999999998 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.577 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 64.129999999999995 111.328 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.200000000000003 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.340000000000003 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.559 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.239999999999995 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 65.299999999999997 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 64.140000000000001 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.230000000000004 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.420000000000002 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.409999999999997 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.200000000000003 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.310000000000002 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 51.409999999999997 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 73.519999999999996 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 64.129999999999995 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 72.239999999999995 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.230000000000004 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 73.120000000000005 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.71 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.340000000000003 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 70.310000000000002 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 71.200000000000003 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 64.409999999999997 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.530000000000001 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.645 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.420000000000002 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.010000000000005 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 62.100000000000001 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.299999999999997 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 73.299999999999997 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.559 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 62.009999999999998 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.71 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.319999999999993 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.530000000000001 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 55.439999999999998 110.21 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.019999999999996 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.349999999999994 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.319999999999993 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.420000000000002 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 71.409999999999997 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 61.130000000000003 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.430000000000007 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.030000000000001 109.169 172.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.68 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.310000000000002 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 71.340000000000003 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 72.25 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 61.409999999999997 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.239999999999995 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.040000000000006 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 59' ' ' ILE . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.209999999999994 109.268 173.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 64.1 t30 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.430000000000007 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.510000000000005 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 65.109999999999999 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.019999999999996 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.406 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 73.25 112.126 -173.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.019999999999996 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.409999999999997 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.200000000000003 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 65.120000000000005 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.701 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 65.200000000000003 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.573 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.439999999999998 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HB2' ' A' ' 61' ' ' GLU . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 65.129999999999995 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.51 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.329999999999998 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.239999999999995 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.319999999999993 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 70.030000000000001 109.726 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.409999999999997 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.450000000000003 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.329999999999998 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 64.209999999999994 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 62.229999999999997 110.001 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.519999999999996 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.603 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 64.310000000000002 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.230000000000004 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 31.239999999999998 111.74 -178.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.439999999999998 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.510000000000005 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 95.2 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.120000000000005 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.109999999999999 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.439999999999998 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.701 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.53 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.109999999999999 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.150000000000006 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.010000000000005 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.629 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.219999999999999 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 73.219999999999999 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.200000000000003 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.150000000000006 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 71.439999999999998 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 73.439999999999998 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 43.329999999999998 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.420000000000002 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.140000000000001 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.431 HG22 ' HA ' ' A' ' 96' ' ' GLN . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.340000000000003 111.296 177.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.219999999999999 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.430000000000007 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 52.200000000000003 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 62.210000000000001 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 72.239999999999995 108.849 -178.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.439999999999998 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.299999999999997 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.53 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 73.209999999999994 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 34.32 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.329999999999998 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 63.109999999999999 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.030000000000001 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 74.540000000000006 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.450000000000003 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 70.519999999999996 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.512 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.329999999999998 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 118' ' ' LYS . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.319999999999993 111.079 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 65.200000000000003 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 42.229999999999997 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 65.430000000000007 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 71.150000000000006 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.874 0.369 . . . . 75.030000000000001 110.46 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -103.72 119.37 38.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.232 -0.44 . . . . 61.030000000000001 109.983 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -91.38 111.66 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.199 -0.667 . . . . 71.219999999999999 109.199 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm -69.32 -40.93 77.34 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.614 0.598 . . . . 72.120000000000005 112.614 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 61.240000000000002 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HB3' ' A' ' 3' ' ' GLU . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 72.310000000000002 111.353 -178.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.200000000000003 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.420000000000002 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 63.109999999999999 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 62.149999999999999 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.039999999999999 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 71.400000000000006 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.548 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.239999999999995 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.319999999999993 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.729 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 74.409999999999997 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 64.200000000000003 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.130000000000003 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 60.340000000000003 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 63.219999999999999 109.741 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 53.219999999999999 113.128 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 23' ' ' SER . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 54.25 109.203 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.140000000000001 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 53.299999999999997 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.200000000000003 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 61.200000000000003 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.310000000000002 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 55.409999999999997 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.418 HD13 ' HB3' ' A' ' 116' ' ' LEU . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 71.510000000000005 110.898 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.240000000000002 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.019999999999996 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 63.119999999999997 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 34.119999999999997 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 19.9 mm-40 -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 72.340000000000003 110.292 178.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.510000000000005 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.319999999999993 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.507 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 71.430000000000007 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.519999999999996 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.219999999999999 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.310000000000002 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 71.010000000000005 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.492 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 70.430000000000007 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.841 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 60.229999999999997 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 70.140000000000001 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 61.149999999999999 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.349999999999994 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 63.25 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 64.129999999999995 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.140000000000001 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.462 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 65.25 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 71.219999999999999 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.804 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 73.530000000000001 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 71.239999999999995 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 65.7 t30 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.219999999999999 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.340000000000003 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 73.349999999999994 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.340000000000003 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.457 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.409999999999997 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 70.209999999999994 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 54.539999999999999 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.430000000000007 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.209999999999994 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.230000000000004 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.040000000000006 109.414 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.140000000000001 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.450000000000003 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 71.230000000000004 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 65.340000000000003 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.140000000000001 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.841 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 63.340000000000003 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 73.530000000000001 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 34.409999999999997 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 62.0 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 72.099999999999994 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 72.340000000000003 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 72.209999999999994 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 51.409999999999997 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.049999999999997 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.209999999999994 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 44.32 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.299999999999997 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.219999999999999 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 52.140000000000001 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.209999999999994 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.239999999999995 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.310000000000002 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.200000000000003 109.54 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.430000000000007 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.430000000000007 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 70.409999999999997 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.804 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 60.049999999999997 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.119999999999997 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.349999999999994 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.099999999999994 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.120000000000005 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.430000000000007 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.040000000000006 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.340000000000003 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.329999999999998 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.329999999999998 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.209999999999994 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 60.439999999999998 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.319999999999993 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 63.310000000000002 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 64.230000000000004 108.756 177.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.409999999999997 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 63.229999999999997 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 63.399999999999999 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.200000000000003 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.209999999999994 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.010000000000005 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.310000000000002 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 61.229999999999997 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.418 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.310000000000002 110.023 177.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 1.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.409999999999997 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 62.420000000000002 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.310000000000002 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 61.109999999999999 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.340000000000003 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.120000000000005 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.957 0.408 . . . . 71.010000000000005 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -124.88 75.26 1.42 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.702 -0.481 . . . . 70.450000000000003 109.702 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -80.94 155.79 26.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.681 -0.691 . . . . 71.230000000000004 111.452 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -62.74 -23.67 67.3 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.867 -0.606 . . . . 70.540000000000006 112.004 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.581 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 71.129999999999995 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 64.450000000000003 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.637 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 63.130000000000003 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.010000000000005 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.109999999999999 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 72.340000000000003 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 64.349999999999994 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 64.319999999999993 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.120000000000005 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.420000000000002 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.636 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.129999999999995 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.96 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.420000000000002 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.96 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 65.030000000000001 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.675 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 72.230000000000004 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 43.329999999999998 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.099999999999994 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.099999999999994 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.140000000000001 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 43.450000000000003 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.239999999999995 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.669 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 61.539999999999999 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.534 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 65.510000000000005 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.450000000000003 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.933 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 73.420000000000002 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.310000000000002 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 52.210000000000001 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.420000000000002 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.409999999999997 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.722 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.510000000000005 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 72.310000000000002 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.549999999999997 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.441 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 71.299999999999997 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 73.400000000000006 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.744 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 54.219999999999999 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 62.25 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 74.230000000000004 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.530000000000001 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.409999999999997 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.519999999999996 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.634 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 53.420000000000002 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.150000000000006 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.519999999999996 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.109999999999999 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.534 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 64.109999999999999 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.633 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 72.420000000000002 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 63.200000000000003 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.329999999999998 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 61.409999999999997 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 61.409999999999997 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.420000000000002 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 64.200000000000003 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.329999999999998 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.109999999999999 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 50.539999999999999 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.763 ' HG3' ' HB3' ' A' ' 87' ' ' ASP . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 65.040000000000006 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 71.219999999999999 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 65.349999999999994 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.130000000000003 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 64.209999999999994 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.430000000000007 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.219999999999999 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 63.229999999999997 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.130000000000003 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 25.420000000000002 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 71.25 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.441 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 72.510000000000005 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 60.530000000000001 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.624 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.299999999999997 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 64.430000000000007 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.140000000000001 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.755 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 71.230000000000004 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.030000000000001 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.010000000000005 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.040000000000006 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.763 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.310000000000002 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.43 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.219999999999999 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.575 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 62.240000000000002 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 71.120000000000005 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.43 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 71.030000000000001 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.633 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 61.200000000000003 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.534 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.200000000000003 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.129999999999995 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.458 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.120000000000005 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.340000000000003 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.219999999999999 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.644 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.439999999999998 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.209999999999994 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.240000000000002 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.531 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.120000000000005 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 44.329999999999998 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 71.510000000000005 108.783 177.833 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.430000000000007 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.575 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 44.100000000000001 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.019999999999996 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.340000000000003 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.57 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 73.329999999999998 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 64.420000000000002 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 64.329999999999998 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 51.119999999999997 110.822 -179.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.933 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.030000000000001 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.540000000000006 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 72.030000000000001 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.439999999999998 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 73.319999999999993 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.310000000000002 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.982 0.42 . . . . 64.120000000000005 111.504 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.4 pm0 -88.27 121.08 30.25 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.154 -0.684 . . . . 71.239999999999995 109.154 172.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.415 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 1.1 tm-20 -127.12 137.1 52.92 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.105 -0.498 . . . . 75.439999999999998 109.746 -172.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt -66.7 -37.14 84.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.518 0.562 . . . . 74.109999999999999 112.518 -169.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.209999999999994 110.864 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 65.219999999999999 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.209999999999994 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.230000000000004 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.400000000000006 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.340000000000003 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 52.549999999999997 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.540000000000006 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.450000000000003 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.140000000000001 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 72.219999999999999 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.529 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.349999999999994 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.529 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.340000000000003 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.129999999999995 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.789 HG21 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 72.109999999999999 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.530000000000001 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.510000000000005 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.441 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.420000000000002 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.678 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.430000000000007 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.789 ' HB2' HG21 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 44.229999999999997 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 72.019999999999996 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.239999999999995 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 70.420000000000002 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 53.350000000000001 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.597 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 71.329999999999998 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 71.319999999999993 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.450000000000003 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.651 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 65.030000000000001 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 71.400000000000006 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 62.450000000000003 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.219999999999999 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.030000000000001 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 72.230000000000004 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.414 ' HE1' ' HG2' ' A' ' 28' ' ' GLU . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.349999999999994 111.203 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 62.420000000000002 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.530000000000001 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.209999999999994 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.230000000000004 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.230000000000004 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.409999999999997 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.319999999999993 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.129999999999995 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 54.340000000000003 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.120000000000005 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.230000000000004 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 61.229999999999997 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.109999999999999 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.444 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.140000000000001 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 65.430000000000007 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HB2' HD13 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 71.430000000000007 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 64.129999999999995 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HA ' HG23 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 71.439999999999998 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.319999999999993 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.593 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 74.349999999999994 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.219999999999999 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.239999999999995 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.329999999999998 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.446 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.150000000000006 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.099999999999994 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 72.219999999999999 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.613 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.400000000000006 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 64.340000000000003 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 73.209999999999994 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.019999999999996 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' A' ' 75' ' ' ILE . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.040000000000006 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.010000000000005 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.44 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.519999999999996 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 44.509999999999998 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.44 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.099999999999994 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.420000000000002 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.409999999999997 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.613 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 62.32 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 54.340000000000003 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 73.450000000000003 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 74.010000000000005 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.140000000000001 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 71.540000000000006 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.140000000000001 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 64.340000000000003 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 74.140000000000001 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 54.229999999999997 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 64.340000000000003 107.502 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.578 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.319999999999993 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 65.340000000000003 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.449 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.109999999999999 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.628 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.239999999999995 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 70.219999999999999 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.329999999999998 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 65.409999999999997 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.420000000000002 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.678 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.299999999999997 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 71.010000000000005 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 61.509999999999998 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 72.040000000000006 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 73.319999999999993 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.040000000000006 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 71.219999999999999 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.340000000000003 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 63.299999999999997 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.230000000000004 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 73.120000000000005 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.049999999999997 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.578 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 64.530000000000001 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.219999999999999 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.632 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.420000000000002 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.109999999999999 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.525 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.109999999999999 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 74.349999999999994 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 53.539999999999999 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 72.239999999999995 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.574 ' N ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 50.399999999999999 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 63.149999999999999 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.420000000000002 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.597 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 65.329999999999998 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 63.009999999999998 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.319999999999993 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.115 -0.328 . . . . 72.340000000000003 110.115 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.72 122.27 32.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.437 178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -110.27 175.34 5.47 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.759 -0.655 . . . . 63.350000000000001 109.788 176.722 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -64.78 -29.9 70.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.963 0.411 . . . . 74.140000000000001 110.719 -177.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 74.310000000000002 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.409999999999997 110.252 176.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 64.219999999999999 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 63.219999999999999 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.25 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.310000000000002 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 61.549999999999997 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 63.43 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 64.140000000000001 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.409999999999997 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.329999999999998 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.496 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.420000000000002 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.109999999999999 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.230000000000004 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.400000000000006 110.144 173.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 62.119999999999997 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 61.0 108.508 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 64.030000000000001 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.439999999999998 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.427 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 71.120000000000005 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.616 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.140000000000001 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.485 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.409999999999997 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.549999999999997 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 71.040000000000006 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.409999999999997 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.129999999999995 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 63.340000000000003 112.113 -174.02 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 64.129999999999995 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.42 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.150000000000006 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.140000000000001 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.488 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.540000000000006 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.549999999999997 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 73.319999999999993 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 52.409999999999997 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 61.520000000000003 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.450000000000003 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.319999999999993 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.510000000000005 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.239999999999995 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 60.509999999999998 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.129999999999995 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.450000000000003 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.25 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 54.539999999999999 109.869 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 74.519999999999996 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 59' ' ' ILE . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.349999999999994 108.814 173.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.46 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 73.25 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 74.150000000000006 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 71.450000000000003 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HA ' HG23 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 63.310000000000002 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 71.530000000000001 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 63.130000000000003 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 64.040000000000006 111.029 -176.339 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 67' ' ' MET . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.010000000000005 110.319 -176.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.030000000000001 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 72.340000000000003 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.513 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 43.450000000000003 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.430000000000007 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.099999999999994 109.582 171.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.484 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.120000000000005 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.299999999999997 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.409999999999997 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.411 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.991 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.010000000000005 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 42.340000000000003 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.409999999999997 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 63.420000000000002 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.63 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.010000000000005 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.129999999999995 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.310000000000002 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.239999999999995 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.519999999999996 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.019999999999996 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 63.420000000000002 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 54.109999999999999 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 73.150000000000006 109.662 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.129999999999995 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.513 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.439999999999998 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.319999999999993 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.504 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.200000000000003 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.200000000000003 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.109999999999999 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.430000000000007 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.481 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.340000000000003 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.109999999999999 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.120000000000005 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.439999999999998 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 61.210000000000001 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.120000000000005 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 65.420000000000002 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.010000000000005 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.230000000000004 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.481 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.349999999999994 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.150000000000006 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.408 ' HG ' ' HG ' ' A' ' 108' ' ' LEU . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 63.340000000000003 110.669 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 54.039999999999999 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 61.310000000000002 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ILE . . . . . 0.504 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 72.230000000000004 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.100000000000001 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.637 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.510000000000005 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 64.540000000000006 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HA ' HD22 ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.030000000000001 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 64.019999999999996 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 73.549999999999997 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.417 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.340000000000003 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.409 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.549999999999997 111.765 -176.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.219999999999999 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 70.310000000000002 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 34.0 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 70.25 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.430000000000007 110.289 -177.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 109.511 -0.551 . . . . 61.399999999999999 109.511 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HA ' HD23 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 73.549999999999997 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 65.349999999999994 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.010000000000005 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 43.43 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 52.229999999999997 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.499 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 71.540000000000006 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.319999999999993 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.239999999999995 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 50.25 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.709 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.439999999999998 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.709 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.149999999999999 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.329999999999998 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.634 HG11 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.219999999999999 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 72.319999999999993 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.310000000000002 109.599 178.088 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 64.129999999999995 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.702 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 62.030000000000001 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.634 ' HG2' HG11 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.409999999999997 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.705 HD23 HD11 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 43.130000000000003 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 44.119999999999997 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 73.109999999999999 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.450000000000003 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.319999999999993 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.821 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 70.299999999999997 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.705 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.049999999999997 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.350000000000001 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.821 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.450000000000003 110.625 -176.226 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.099999999999994 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.565 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.340000000000003 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 11' ' ' SER . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.109999999999999 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.58 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.129999999999995 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.702 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 71.519999999999996 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 62.340000000000003 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 65.109999999999999 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.450000000000003 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.310000000000002 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 55.439999999999998 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 71.209999999999994 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 70.400000000000006 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.540000000000006 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.329999999999998 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.458 HG21 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.409999999999997 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.408 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 63.549999999999997 109.909 175.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.567 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.430000000000007 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.319999999999993 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 72.239999999999995 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 70.299999999999997 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.040000000000006 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.140000000000001 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 64.329999999999998 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.530000000000001 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.310000000000002 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.561 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 74.430000000000007 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 72.439999999999998 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.420000000000002 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.641 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.120000000000005 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.420000000000002 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.561 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.400000000000006 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.494 ' HB2' ' HE2' ' A' ' 78' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.129999999999995 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.264 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.671 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.040000000000006 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.439999999999998 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 72.310000000000002 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.418 HD22 ' HA ' ' A' ' 72' ' ' ASN . 0.6 OUTLIER -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.510000000000005 110.549 -177.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.240000000000002 110.021 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.555 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.310000000000002 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.409999999999997 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.671 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 53.210000000000001 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.502 ' HG3' HG22 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.530000000000001 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.534 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.299999999999997 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.734 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.349999999999994 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 73.349999999999994 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.420000000000002 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 71.120000000000005 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.641 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.409999999999997 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.475 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 71.310000000000002 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.430000000000007 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 44.340000000000003 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 52.140000000000001 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 64.230000000000004 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.542 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.209999999999994 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.439999999999998 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.469 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 72.430000000000007 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.587 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.530000000000001 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.239999999999995 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.408 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 74.530000000000001 111.061 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.705 HD11 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 64.010000000000005 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.230000000000004 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 60.329999999999998 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.109999999999999 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 71.030000000000001 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 63.039999999999999 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 62.32 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.310000000000002 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 61.420000000000002 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 64.439999999999998 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.422 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 71.239999999999995 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 52.219999999999999 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 72.109999999999999 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.542 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.420000000000002 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 71.349999999999994 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 73.239999999999995 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.656 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 63.0 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.030000000000001 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.428 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.219999999999999 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.514 HE21 ' CA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 55.43 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 72.120000000000005 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 62.210000000000001 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.400000000000006 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.705 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.430000000000007 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.340000000000003 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.446 0.165 . . . . 75.150000000000006 111.138 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 52.229999999999997 110.257 177.409 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.547 HH11 ' HB2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 73.329999999999998 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 64.349999999999994 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.310000000000002 111.349 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.415 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 44.140000000000001 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 63.25 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.109999999999999 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.563 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.340000000000003 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 72.310000000000002 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.815 ' HG3' ' HB2' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.040000000000006 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.45 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.010000000000005 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.109999999999999 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 61.140000000000001 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.687 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 53.030000000000001 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.687 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.109999999999999 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.049999999999997 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 42' ' ' GLU . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.439999999999998 110.374 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.319999999999993 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 60.439999999999998 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.815 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.310000000000002 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.230000000000004 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.556 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 73.510000000000005 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.109999999999999 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 53.340000000000003 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 65.140000000000001 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.329999999999998 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.140000000000001 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 13.1 mm100 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.310000000000002 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 53.32 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.556 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 71.530000000000001 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 72.209999999999994 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.563 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 64.200000000000003 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HB3' HD22 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.409999999999997 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.150000000000006 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 60.100000000000001 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.049999999999997 110.896 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.669 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 62.109999999999999 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 44.039999999999999 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.420000000000002 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.239999999999995 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.669 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.219999999999999 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 51.149999999999999 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.632 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 71.409999999999997 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.47 HG22 HG23 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.209999999999994 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.422 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 71.299999999999997 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.099999999999994 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.310000000000002 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HB3' HG21 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 74.400000000000006 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.240000000000002 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 64.420000000000002 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 70.319999999999993 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.230000000000004 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.420000000000002 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.400000000000006 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.487 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.510000000000005 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 33.210000000000001 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 65.129999999999995 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.030000000000001 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.200000000000003 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.510000000000005 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.150000000000006 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 71.430000000000007 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.420000000000002 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 52.140000000000001 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 65.439999999999998 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.549999999999997 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.219999999999999 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 72.140000000000001 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.439999999999998 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.763 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 65.209999999999994 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.519999999999996 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 70.239999999999995 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.510000000000005 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 65.219999999999999 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.558 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.409999999999997 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.558 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 62.299999999999997 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.239999999999995 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 63.340000000000003 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.45 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.209999999999994 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' LEU . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.420000000000002 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.420000000000002 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 55.409999999999997 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 71.409999999999997 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 63.32 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.120000000000005 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.422 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 50.100000000000001 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.47 HG23 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.632 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.519999999999996 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.239999999999995 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 60.049999999999997 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 63.039999999999999 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.430000000000007 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG11 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.209999999999994 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.450000000000003 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.200000000000003 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.140000000000001 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.540000000000006 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.129999999999995 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.329999999999998 109.577 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.540000000000006 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 51.43 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 30.129999999999999 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 65.129999999999995 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 73.0 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 64.099999999999994 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 61.520000000000003 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 62.020000000000003 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 73.409999999999997 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.239999999999995 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.439999999999998 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.150000000000006 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.477 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 41.520000000000003 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 61.100000000000001 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 121.081 0.467 . . . . 62.520000000000003 110.077 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.510000000000005 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.439999999999998 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.010000000000005 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.109999999999999 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.47 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.119999999999997 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.239999999999995 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.239999999999995 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.519999999999996 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 64.439999999999998 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.517 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.239999999999995 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.439999999999998 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 64.430000000000007 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 61.229999999999997 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.329999999999998 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.552 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 70.430000000000007 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.984 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 54.43 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.209999999999994 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 17' ' ' PRO . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.109999999999999 109.409 -178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.47 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 71.430000000000007 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.129999999999995 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.349999999999994 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 63.030000000000001 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.229999999999997 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.592 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 60.299999999999997 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.510000000000005 111.859 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 81' ' ' GLU . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 44.240000000000002 110.141 -176.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 64.409999999999997 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.409999999999997 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 72.200000000000003 109.828 173.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.566 ' HB3' HD22 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 71.25 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 62.509999999999998 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 74.040000000000006 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.984 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.129999999999995 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 63.119999999999997 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.493 HD11 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 64.25 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 72.319999999999993 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.310000000000002 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.019999999999996 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.120000000000005 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.474 HG22 HG23 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.219999999999999 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.109999999999999 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.540000000000006 109.285 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.549999999999997 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 64.120000000000005 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.219999999999999 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.403 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.310000000000002 112.194 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.010000000000005 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.099999999999994 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 54.409999999999997 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 65.420000000000002 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.230000000000004 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 63.219999999999999 112.358 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 60.0 112.698 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 61.439999999999998 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.485 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.400000000000006 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.239999999999995 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 73.129999999999995 110.9 -175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 64.400000000000006 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 64.120000000000005 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.229999999999997 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.140000000000001 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 53.539999999999999 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.420000000000002 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.493 ' CA ' HD11 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.329999999999998 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 70.140000000000001 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 64.150000000000006 109.252 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.47 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.239999999999995 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.702 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 63.310000000000002 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 74.340000000000003 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 70.200000000000003 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.516 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 73.549999999999997 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 64.150000000000006 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 71.519999999999996 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.430000000000007 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.120000000000005 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.400000000000006 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.465 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 63.240000000000002 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.55 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 71.129999999999995 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 71.400000000000006 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.685 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 54.109999999999999 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.319999999999993 111.146 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.239999999999995 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.474 HG23 HG22 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 54.520000000000003 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.439999999999998 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.350000000000001 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 73.209999999999994 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.310000000000002 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 33.109999999999999 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.510000000000005 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 40.439999999999998 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 72.430000000000007 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.409999999999997 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.636 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 54.530000000000001 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.465 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.030000000000001 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 51.450000000000003 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 72.120000000000005 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.239999999999995 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.636 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.319999999999993 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.140000000000001 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 71.510000000000005 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.704 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 74.0 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.209999999999994 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.109999999999999 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.530000000000001 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.030000000000001 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.310000000000002 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? . . . . . 0 N--CA 1.463 0.182 0 CA-C-O 121.035 0.445 . . . . 74.319999999999993 110.721 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.230000000000004 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.310000000000002 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.507 HD22 ' H ' ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.120000000000005 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.120000000000005 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 51.229999999999997 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 62.039999999999999 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.420000000000002 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.299999999999997 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.140000000000001 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.239999999999995 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.584 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.239999999999995 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 74.530000000000001 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 63.219999999999999 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.412 HG22 HG22 ' A' ' 21' ' ' THR . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 71.129999999999995 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.434 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 70.430000000000007 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 23' ' ' SER . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.239999999999995 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 54.409999999999997 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.239999999999995 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 71.25 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 72.129999999999995 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.319999999999993 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 35.020000000000003 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 61.119999999999997 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.48 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.400000000000006 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.593 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 72.109999999999999 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.806 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 54.140000000000001 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.109999999999999 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.239999999999995 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.593 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 26.3 tp60 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.540000000000006 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.049999999999997 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 74.219999999999999 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.531 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.010000000000005 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.329999999999998 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.566 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.219999999999999 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.571 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.510000000000005 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.040000000000006 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 63.140000000000001 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 70.200000000000003 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.806 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 62.119999999999997 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.806 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 43.340000000000003 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.310000000000002 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.439999999999998 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.310000000000002 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 52.350000000000001 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.439999999999998 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.010000000000005 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 51.310000000000002 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HB3' HG23 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 64.140000000000001 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.099999999999994 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.530000000000001 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.409999999999997 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.240000000000002 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.319999999999993 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.540000000000006 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.549999999999997 109.993 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.549999999999997 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 73.129999999999995 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.400000000000006 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.525 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.209999999999994 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 70.030000000000001 109.459 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.329999999999998 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.049999999999997 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.916 HD13 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 65.340000000000003 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 55.240000000000002 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 71.230000000000004 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.230000000000004 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.420000000000002 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 54.32 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.441 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.530000000000001 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.916 HG12 HD13 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 61.329999999999998 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 54.009999999999998 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.140000000000001 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.525 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.430000000000007 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 53.299999999999997 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 73.540000000000006 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.430000000000007 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.219999999999999 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.430000000000007 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 63.020000000000003 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.606 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 72.430000000000007 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 41.310000000000002 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.439999999999998 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.510000000000005 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.529 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.099999999999994 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 55.299999999999997 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.420000000000002 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.049999999999997 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.319999999999993 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 54.409999999999997 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.219999999999999 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 61.020000000000003 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.109999999999999 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 31.239999999999998 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 70.129999999999995 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 71.310000000000002 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.019999999999996 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.441 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.140000000000001 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 71.310000000000002 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 65.439999999999998 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 72.450000000000003 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.519999999999996 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.209999999999994 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 65.5 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.486 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.319999999999993 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 63.200000000000003 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 70.5 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 70.439999999999998 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.48 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.0 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.310000000000002 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.557 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 63.240000000000002 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 60.25 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.109999999999999 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.806 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 63.32 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp . . . . . 0 C--O 1.231 0.098 0 N-CA-C 108.622 -0.881 . . . . 73.409999999999997 108.622 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 70.010000000000005 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.679 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.409999999999997 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 72.239999999999995 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.340000000000003 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 63.43 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.427 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.040000000000006 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 62.140000000000001 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 51.450000000000003 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 64.510000000000005 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.476 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.239999999999995 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.788 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.340000000000003 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.788 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 71.109999999999999 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.010000000000005 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.140000000000001 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 54.299999999999997 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.786 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 44.210000000000001 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.399999999999999 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.476 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.049999999999997 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 65.109999999999999 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.219999999999999 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.310000000000002 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.537 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 63.32 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 62.509999999999998 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 71.430000000000007 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.702 ' H ' ' HD2' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 65.299999999999997 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 34.219999999999999 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.340000000000003 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 64.310000000000002 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.55 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.239999999999995 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 50.140000000000001 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 64.120000000000005 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.499 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 73.299999999999997 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.532 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.420000000000002 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 64.430000000000007 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.786 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.546 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 61.149999999999999 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.239999999999995 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 53.149999999999999 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.129999999999995 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.109999999999999 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.230000000000004 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.25 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.209999999999994 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.535 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.319999999999993 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 71.239999999999995 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.340000000000003 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.140000000000001 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 72.540000000000006 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 71.230000000000004 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 64.340000000000003 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.340000000000003 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 53.409999999999997 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.319999999999993 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.540000000000006 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.109999999999999 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.340000000000003 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.434 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.019999999999996 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 73.519999999999996 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.491 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 64.040000000000006 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 71.409999999999997 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.239999999999995 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.299999999999997 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.546 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.209999999999994 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.510000000000005 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 52.530000000000001 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 71.239999999999995 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 74.120000000000005 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.491 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 70.0 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.129999999999995 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.472 ' O ' HG12 ' A' ' 35' ' ' VAL . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 63.299999999999997 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 64.439999999999998 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 71.329999999999998 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.584 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 26.4 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 64.150000000000006 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.129999999999995 110.556 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.329999999999998 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 64.209999999999994 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.030000000000001 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.416 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 42.329999999999998 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.450000000000003 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 61.030000000000001 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.698 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.230000000000004 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.349999999999994 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.535 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 72.239999999999995 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.510000000000005 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.598 ' HA ' HG22 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.120000000000005 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.140000000000001 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 43.530000000000001 111.397 174.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 71.219999999999999 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 73.430000000000007 110.046 176.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 54.009999999999998 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.420000000000002 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.319999999999993 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.530000000000001 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.530000000000001 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.329999999999998 109.168 -177.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.427 ' HB ' HG23 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 54.399999999999999 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.409999999999997 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.416 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 74.510000000000005 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.409999999999997 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 63.43 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.319999999999993 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 71.439999999999998 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 73.109999999999999 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.019999999999996 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 72.019999999999996 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.129999999999995 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 72.420000000000002 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.530000000000001 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 51.149999999999999 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.219999999999999 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 72.209999999999994 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.519 0.199 . . . . 74.430000000000007 111.252 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.519999999999996 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.209999999999994 109.894 172.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 62.140000000000001 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 72.140000000000001 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.439999999999998 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 61.0 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.109999999999999 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.230000000000004 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.420000000000002 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.569 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.340000000000003 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.430000000000007 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 19' ' ' VAL . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 63.009999999999998 110.015 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.459 ' N ' HG22 ' A' ' 18' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 72.230000000000004 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 73.530000000000001 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.437 HG22 ' OE1' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.049999999999997 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.450000000000003 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.579 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.310000000000002 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 64.0 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 70.299999999999997 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HZ2' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.099999999999994 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.420000000000002 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 53.43 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 71.319999999999993 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 65.129999999999995 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.528 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.030000000000001 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.528 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 54.329999999999998 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.120000000000005 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.439999999999998 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 80' ' ' MET . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.310000000000002 111.239 -176.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.319999999999993 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.019999999999996 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.319999999999993 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.120000000000005 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.432 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.240000000000002 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.775 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.120000000000005 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.535 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.010000000000005 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 64.230000000000004 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 61.539999999999999 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 40.020000000000003 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.130000000000003 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.200000000000003 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.519999999999996 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.430000000000007 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.109999999999999 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 65.239999999999995 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.420000000000002 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.040000000000006 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 4.0 t-20 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.530000000000001 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.450000000000003 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.430000000000007 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.439 ' HG3' HD13 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.219999999999999 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.549999999999997 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.329999999999998 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CG ' ' H ' ' A' ' 67' ' ' MET . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.140000000000001 109.592 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 62.009999999999998 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.530000000000001 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.578 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.200000000000003 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.432 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.239999999999995 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 71.0 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.428 ' H ' ' CG ' ' A' ' 61' ' ' GLU . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.150000000000006 110.339 -176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 72.200000000000003 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.319999999999993 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.0 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 70.349999999999994 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.010000000000005 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.340000000000003 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.120000000000005 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.530000000000001 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.150000000000006 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.471 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.540000000000006 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.421 ' HB2' ' HB ' ' A' ' 35' ' ' VAL . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 72.209999999999994 112.074 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.120000000000005 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.519999999999996 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 62.229999999999997 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 16.4 mm100 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 71.109999999999999 112.447 -174.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 73.439999999999998 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.219999999999999 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.578 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.530000000000001 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.423 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.209999999999994 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 71.510000000000005 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 70.400000000000006 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.423 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 70.239999999999995 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.543 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 70.450000000000003 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 62.299999999999997 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 63.219999999999999 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.239999999999995 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 64.340000000000003 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.349999999999994 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 54.210000000000001 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.420000000000002 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 54.200000000000003 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 52.229999999999997 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 72.530000000000001 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.669 ' HB2' HD11 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.299999999999997 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.140000000000001 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.010000000000005 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 63.009999999999998 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.542 HD22 ' HA ' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 61.25 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 63.329999999999998 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.340000000000003 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.450000000000003 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.450000000000003 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HA ' HD22 ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 54.420000000000002 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 64.209999999999994 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.129999999999995 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 73.030000000000001 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 73.109999999999999 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.329999999999998 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 70.239999999999995 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 72.340000000000003 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 120.873 0.368 . . . . 75.150000000000006 111.37 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.120000000000005 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.688 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.239999999999995 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.230000000000004 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 71.340000000000003 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.439999999999998 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 65.140000000000001 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.433 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.430000000000007 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.482 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.540000000000006 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 70.340000000000003 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.340000000000003 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.435 ' HE2' ' HB1' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 62.520000000000003 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 62.119999999999997 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.409999999999997 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.405 HG22 ' HG3' ' A' ' 24' ' ' GLU . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 63.32 110.617 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 71.299999999999997 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 64.120000000000005 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 50.119999999999997 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.732 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.25 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HG3' HG22 ' A' ' 18' ' ' THR . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 109.204 173.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.972 HD23 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.129999999999995 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.435 ' HB1' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 61.520000000000003 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 71.430000000000007 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.506 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.430000000000007 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 70.439999999999998 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.599 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 72.239999999999995 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.319999999999993 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.489 HE22 ' HB3' ' A' ' 81' ' ' GLU . 17.3 mm-40 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 72.25 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.299999999999997 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.539 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.409999999999997 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.219999999999999 108.415 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.482 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.150000000000006 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.51 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.200000000000003 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.732 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 53.420000000000002 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.409999999999997 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 64.129999999999995 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 52.299999999999997 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.540000000000006 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.409999999999997 110.077 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 50.109999999999999 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 65.140000000000001 110.277 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.019999999999996 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.422 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 61.340000000000003 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 51.219999999999999 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.340000000000003 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 74.420000000000002 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 64.209999999999994 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.209999999999994 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 72.040000000000006 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.549999999999997 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.219999999999999 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.329999999999998 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.150000000000006 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 72.430000000000007 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.430000000000007 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.109999999999999 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 40.25 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 54.109999999999999 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.439999999999998 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 62.109999999999999 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.299999999999997 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.566 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 72.530000000000001 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 64.340000000000003 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 61.210000000000001 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 70.510000000000005 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.451 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.129999999999995 107.121 167.534 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 55.439999999999998 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.420000000000002 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.402 HD13 ' HA ' ' A' ' 40' ' ' GLN . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 71.319999999999993 110.222 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.400000000000006 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.566 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.450000000000003 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.219999999999999 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.688 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.439999999999998 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.489 ' HB3' HE22 ' A' ' 34' ' ' GLN . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.430000000000007 108.453 170.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 64.310000000000002 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' LEU . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 64.400000000000006 107.966 175.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 55.420000000000002 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.409999999999997 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 83' ' ' LEU . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.340000000000003 109.41 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.627 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.409999999999997 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.409999999999997 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.310000000000002 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.010000000000005 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.472 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.299999999999997 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 54.329999999999998 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.240000000000002 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.972 HD11 HD23 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.530000000000001 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 73.219999999999999 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.536 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 71.150000000000006 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 53.100000000000001 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.209999999999994 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 74.230000000000004 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 61.140000000000001 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.210000000000001 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.329999999999998 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.510000000000005 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.329999999999998 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 51.530000000000001 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.239999999999995 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 62.520000000000003 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.510000000000005 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.129999999999995 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 73.530000000000001 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.637 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.140000000000001 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 53.130000000000003 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 72.219999999999999 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 70.230000000000004 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.230000000000004 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.450000000000003 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.415 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 72.129999999999995 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.439999999999998 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.510000000000005 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm . . . . . 0 CA--C 1.53 0.178 0 N-CA-C 111.753 0.279 . . . . 75.519999999999996 111.753 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.416 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.109999999999999 111.457 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.478 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 70.439999999999998 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 44.350000000000001 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 65.420000000000002 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.77 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 64.310000000000002 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 10' ' ' LEU . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.099999999999994 108.823 176.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.407 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.200000000000003 109.931 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.340000000000003 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.209999999999994 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 70.150000000000006 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 71.409999999999997 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.514 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.239999999999995 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.010000000000005 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.465 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 24.239999999999998 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.998 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.209999999999994 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.998 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.450000000000003 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.099999999999994 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 42.439999999999998 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.299999999999997 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 65.219999999999999 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.140000000000001 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.230000000000004 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.540000000000006 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.219999999999999 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.404 HG22 ' HG3' ' A' ' 117' ' ' GLN . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 64.510000000000005 110.574 -176.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.540000000000006 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.039999999999999 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 54.549999999999997 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 41.420000000000002 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.76 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.420000000000002 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 64.5 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 11' ' ' SER . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.219999999999999 110.077 -178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.529 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.549999999999997 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.624 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 61.340000000000003 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.512 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.329999999999998 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.349999999999994 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 45.219999999999999 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.420000000000002 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.450000000000003 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.564 HD13 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 71.010000000000005 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.340000000000003 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 62.539999999999999 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.340000000000003 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.409999999999997 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 72.540000000000006 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.099999999999994 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 64.420000000000002 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 53.420000000000002 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.420000000000002 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 63.439999999999998 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 63.240000000000002 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 73.400000000000006 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 64.049999999999997 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 72.340000000000003 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.230000000000004 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.230000000000004 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.109999999999999 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.310000000000002 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.209999999999994 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.478 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 54.219999999999999 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.210000000000001 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.040000000000006 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.553 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.430000000000007 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.519999999999996 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.893 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 73.430000000000007 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 73.129999999999995 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 72.109999999999999 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 62.229999999999997 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 70.0 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.553 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.239999999999995 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 70.329999999999998 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.329999999999998 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.77 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.400000000000006 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.099999999999994 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.76 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 65.420000000000002 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.049999999999997 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.209999999999994 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.109999999999999 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 70.219999999999999 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 72.239999999999995 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.150000000000006 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.219999999999999 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 62.409999999999997 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.200000000000003 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.299999999999997 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.487 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 72.329999999999998 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.349999999999994 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.510000000000005 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.430000000000007 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.430000000000007 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 43.109999999999999 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.971 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.099999999999994 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.109999999999999 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.150000000000006 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 62.32 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.200000000000003 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 63.229999999999997 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 70.219999999999999 109.339 -177.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.299999999999997 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.409999999999997 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 65.140000000000001 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.030000000000001 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.219999999999999 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.109999999999999 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.586 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.519999999999996 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 73.319999999999993 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.529 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 71.540000000000006 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 119' ' ' GLU . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 65.329999999999998 110.735 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.200000000000003 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.130000000000003 111.725 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 63.32 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.540000000000006 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 53.32 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.120000000000005 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.682 0.277 . . . . 72.200000000000003 110.886 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.239999999999995 110.671 -178.62 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 77' ' ' GLU . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.319999999999993 110.415 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 73.019999999999996 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 61.25 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.450000000000003 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 61.219999999999999 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.349999999999994 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.604 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.530000000000001 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.450000000000003 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.450000000000003 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 71.409999999999997 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 61.310000000000002 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.628 HG22 HG22 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 73.120000000000005 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 54.509999999999998 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.628 HG22 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.219999999999999 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.319999999999993 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.471 ' H ' HG23 ' A' ' 21' ' ' THR . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 60.200000000000003 110.003 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.667 ' HB3' HE22 ' A' ' 40' ' ' GLN . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.109999999999999 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.487 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.129999999999995 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 72.209999999999994 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 52.509999999999998 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 64.140000000000001 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 65.420000000000002 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 73.340000000000003 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.310000000000002 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.711 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.519999999999996 110.036 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.150000000000006 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.310000000000002 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.230000000000004 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 61.549999999999997 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.667 HE22 ' HB3' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.120000000000005 110.646 -178.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 71.010000000000005 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.49 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.209999999999994 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.49 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.519999999999996 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.509 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.230000000000004 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.129999999999995 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 72.409999999999997 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.510000000000005 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.519999999999996 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.230000000000004 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 71.239999999999995 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 40.140000000000001 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.400000000000006 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.109999999999999 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 71.439999999999998 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 62.409999999999997 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.049999999999997 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 44.219999999999999 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.439999999999998 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 64.030000000000001 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 71.230000000000004 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HG3' ' HD2' ' A' ' 66' ' ' LYS . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 65.340000000000003 109.715 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.401 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 64.430000000000007 113.26 -173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.229999999999997 113.586 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 1.007 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 41.329999999999998 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 72.329999999999998 109.458 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.403 ' HD2' ' HG3' ' A' ' 61' ' ' GLU . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.239999999999995 109.65 176.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.409999999999997 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.219999999999999 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.150000000000006 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 74.140000000000001 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.815 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 62.210000000000001 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.420000000000002 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.230000000000004 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 61.420000000000002 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 63.329999999999998 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.329999999999998 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE1' ' HB3' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.329999999999998 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 67' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 64.519999999999996 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 54.420000000000002 110.875 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.62 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.329999999999998 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.602 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 52.039999999999999 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 1.007 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 64.049999999999997 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.319999999999993 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 71.340000000000003 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.239999999999995 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.499 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.310000000000002 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.492 ' HA2' HG23 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.399999999999999 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 51.130000000000003 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 64.120000000000005 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.783 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.129999999999995 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 71.319999999999993 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.329999999999998 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.099999999999994 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HB3' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.409999999999997 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.530000000000001 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 33.450000000000003 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 63.520000000000003 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 63.200000000000003 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 62.509999999999998 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.030000000000001 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 73.040000000000006 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.519999999999996 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 64.040000000000006 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 70.209999999999994 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.319999999999993 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.200000000000003 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.492 HG23 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.340000000000003 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.039999999999999 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 34.200000000000003 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.400000000000006 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.209999999999994 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 71.120000000000005 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.140000000000001 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 71.420000000000002 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 31' ' ' GLU . 7.5 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 73.319999999999993 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 63.409999999999997 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.230000000000004 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 60.130000000000003 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.150000000000006 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 62.409999999999997 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm . . . . . 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.329999999999998 112.593 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 62.43 112.16 -170.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 74.25 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 7' ' ' LEU . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 53.420000000000002 110.5 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.409999999999997 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.329999999999998 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.310000000000002 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.563 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.009999999999998 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.340000000000003 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.120000000000005 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.430000000000007 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.72 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 63.140000000000001 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.439999999999998 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 53.439999999999998 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG22 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.430000000000007 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.506 ' H ' HG22 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 61.520000000000003 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 63.149999999999999 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.409999999999997 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.310000000000002 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.598 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 71.439999999999998 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.310000000000002 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 53.409999999999997 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 51.009999999999998 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 63.219999999999999 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 72.319999999999993 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 121' ' ' GLU . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 64.120000000000005 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.319999999999993 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.485 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 9.4 mm100 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 73.510000000000005 112.188 -162.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 65.200000000000003 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.563 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 65.349999999999994 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.595 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.549999999999997 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 72.129999999999995 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.514 ' HB3' HD22 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.209999999999994 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.409999999999997 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 73.319999999999993 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 62.520000000000003 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.209999999999994 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 70.439999999999998 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.030000000000001 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 62.210000000000001 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.349999999999994 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.420000000000002 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.463 ' CG ' ' HB3' ' A' ' 96' ' ' GLN . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 63.43 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.53 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 73.409999999999997 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.409999999999997 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.549 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.109999999999999 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.608 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.319999999999993 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.430000000000007 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 62.109999999999999 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.409999999999997 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.109999999999999 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 63.450000000000003 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 71.549999999999997 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 73.420000000000002 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 64.439999999999998 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.129999999999995 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 64.329999999999998 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.150000000000006 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.481 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 41.520000000000003 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 63.439999999999998 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 64.310000000000002 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.239999999999995 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.299999999999997 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.219999999999999 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 65.409999999999997 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.430000000000007 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.509999999999998 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.420000000000002 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 64.430000000000007 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 72.129999999999995 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.442 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 63.420000000000002 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 71.049999999999997 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.65 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.340000000000003 109.749 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 53.030000000000001 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.463 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.463 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 64.540000000000006 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.310000000000002 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.51 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.329999999999998 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 74.519999999999996 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 74.329999999999998 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.439999999999998 109.882 176.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.608 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.109999999999999 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.040000000000006 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.53 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 51.329999999999998 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.582 ' HA ' HG22 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 52.130000000000003 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.349999999999994 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 63.509999999999998 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 74.349999999999994 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 52.509999999999998 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.329999999999998 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.413 ' O ' ' HB ' ' A' ' 95' ' ' ILE . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.140000000000001 111.975 175.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 64.409999999999997 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.598 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.120000000000005 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 65.420000000000002 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.510000000000005 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.562 HG13 HG11 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.430000000000007 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 64.430000000000007 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 63.119999999999997 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . 0.423 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.299999999999997 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.010000000000005 111.35 -176.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.562 HG11 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 71.200000000000003 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.019999999999996 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.329999999999998 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 72.319999999999993 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 64.340000000000003 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.53 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 65.230000000000004 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.409999999999997 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 33.32 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.478 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.450000000000003 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 55.420000000000002 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 112.031 0.382 . . . . 54.539999999999999 112.031 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 62.140000000000001 111.202 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 71.099999999999994 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.519999999999996 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.230000000000004 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 64.5 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.229999999999997 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.019999999999996 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.010000000000005 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 62.100000000000001 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.120000000000005 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 54.130000000000003 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 70.530000000000001 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.439999999999998 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 73.439999999999998 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.471 ' O ' HG13 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 54.340000000000003 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 74.040000000000006 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 63.310000000000002 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 65.099999999999994 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.828 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 72.530000000000001 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.493 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 61.329999999999998 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 52.409999999999997 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.584 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 72.109999999999999 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.439999999999998 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.129999999999995 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.631 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.239999999999995 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.631 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.439999999999998 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.430000000000007 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 9.4 mm100 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 62.530000000000001 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 63.030000000000001 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 64.019999999999996 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.540000000000006 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.427 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.409999999999997 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.505 ' HB3' HD22 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 72.310000000000002 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.474 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.400000000000006 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 72.25 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.601 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 64.310000000000002 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.239999999999995 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.462 ' H ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 54.240000000000002 109.381 175.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 53.119999999999997 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.200000000000003 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.230000000000004 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.010000000000005 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 62.399999999999999 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 70.109999999999999 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 64.310000000000002 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.512 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 61.32 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 62.240000000000002 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 73.099999999999994 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.129999999999995 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 65.120000000000005 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 71.450000000000003 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.349999999999994 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.150000000000006 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.120000000000005 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.310000000000002 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.310000000000002 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 50.340000000000003 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.329999999999998 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 64.409999999999997 110.59 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 70.340000000000003 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 111.162 -175.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.430000000000007 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 72.540000000000006 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.510000000000005 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.129999999999995 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 43.25 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 65.340000000000003 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 60.530000000000001 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 54.439999999999998 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.019999999999996 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 61.140000000000001 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 72.430000000000007 109.32 177.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.230000000000004 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.099999999999994 110.766 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.310000000000002 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.310000000000002 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.239999999999995 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.529 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 65.310000000000002 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.529 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 62.340000000000003 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 63.32 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.451 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 44.340000000000003 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 63.119999999999997 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.439999999999998 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.310000000000002 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.219999999999999 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.686 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.010000000000005 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 73.450000000000003 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.209999999999994 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 64.540000000000006 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.140000000000001 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.614 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.409999999999997 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 72.439999999999998 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 55.109999999999999 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.614 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 73.109999999999999 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 64.0 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.299999999999997 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 72.450000000000003 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.828 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 64.409999999999997 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.409999999999997 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.409999999999997 109.112 -175.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 61.439999999999998 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 64.120000000000005 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.030000000000001 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 62.109999999999999 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.430000000000007 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.150000000000006 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.56 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 64.150000000000006 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.129999999999995 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.040000000000006 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 71.230000000000004 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.55 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.219999999999999 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.209999999999994 111.687 176.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.519999999999996 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 61.329999999999998 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.040000000000006 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.209999999999994 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.461 0.117 0 CA-C-O 120.688 0.28 . . . . 70.219999999999999 111.058 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.540000000000006 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 64.530000000000001 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 54.229999999999997 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.310000000000002 110.396 174.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 65.239999999999995 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.319999999999993 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.109999999999999 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 74.439999999999998 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.030000000000001 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 73.409999999999997 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.607 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 55.009999999999998 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 51.009999999999998 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.400000000000006 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.787 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.340000000000003 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.787 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.519999999999996 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.455 ' H ' HG23 ' A' ' 19' ' ' VAL . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.140000000000001 111.087 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.8 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 62.509999999999998 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.340000000000003 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.219999999999999 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.579 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 71.129999999999995 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 63.130000000000003 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 63.509999999999998 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.510000000000005 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 45.219999999999999 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.603 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.530000000000001 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 55.240000000000002 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 65.25 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.466 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.340000000000003 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.450000000000003 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.591 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.129999999999995 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.483 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.120000000000005 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 64.349999999999994 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 52.539999999999999 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 71.030000000000001 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 73.439999999999998 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.319999999999993 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.8 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 73.0 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.588 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 41.409999999999997 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.200000000000003 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 65.049999999999997 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 64.219999999999999 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 64.540000000000006 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.200000000000003 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.040000000000006 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.423 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.430000000000007 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 62.340000000000003 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.542 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.646 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.340000000000003 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.039999999999999 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.549999999999997 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.439999999999998 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 73.010000000000005 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.109999999999999 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.150000000000006 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.429 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.329999999999998 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.140000000000001 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.329999999999998 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.812 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 73.140000000000001 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.481 ' CD1' ' HE2' ' A' ' 80' ' ' MET . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 111.029 -170.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.219999999999999 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.299999999999997 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 60.420000000000002 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 70.230000000000004 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 62.399999999999999 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.340000000000003 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.120000000000005 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 55.25 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 64.010000000000005 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.545 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 64.400000000000006 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.558 ' HG2' HD21 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.430000000000007 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.553 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 52.149999999999999 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 62.200000000000003 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.591 ' HB3' ' HB ' ' A' ' 35' ' ' VAL . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.219999999999999 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 61.229999999999997 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.466 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.010000000000005 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.812 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 61.299999999999997 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 55.039999999999999 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.210000000000001 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.319999999999993 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 74.329999999999998 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.461 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.219999999999999 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 32.020000000000003 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.030000000000001 109.227 173.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.689 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 55.229999999999997 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.542 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.010000000000005 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.019999999999996 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 45.399999999999999 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.030000000000001 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.340000000000003 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.510000000000005 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.109999999999999 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 54.030000000000001 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 73.540000000000006 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.209999999999994 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.099999999999994 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.409999999999997 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.450000000000003 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 50.229999999999997 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 71.439999999999998 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.424 HD22 ' HB2' ' A' ' 113' ' ' TYR . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.310000000000002 110.297 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.461 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 71.329999999999998 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 53.350000000000001 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.661 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.519999999999996 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 72.109999999999999 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.424 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.030000000000001 112.437 -175.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 54.310000000000002 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.129999999999995 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.401 ' HG ' HD11 ' A' ' 106' ' ' LEU . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 64.549999999999997 110.497 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 62.130000000000003 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 73.329999999999998 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.230000000000004 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.420000000000002 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.430000000000007 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.420000000000002 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm . . . . . 0 N--CA 1.458 -0.059 0 N-CA-C 112.815 0.672 . . . . 72.299999999999997 112.815 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 73.409999999999997 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 50.520000000000003 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 72.310000000000002 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.209999999999994 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.414 ' HB2' ' HD1' ' A' ' 79' ' ' PHE . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.200000000000003 110.99 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.519999999999996 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 61.200000000000003 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.129999999999995 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 62.509999999999998 109.715 178.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.430000000000007 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 72.400000000000006 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 73.209999999999994 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.319999999999993 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 65.420000000000002 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 70.019999999999996 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.150000000000006 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.439999999999998 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.340000000000003 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.239999999999995 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 70.099999999999994 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 72.230000000000004 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.130000000000003 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.209999999999994 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.299999999999997 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 72.319999999999993 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 44.229999999999997 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.459 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 62.43 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.430000000000007 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.329999999999998 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 12.1 mm100 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.340000000000003 111.984 -169.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.549999999999997 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.595 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 73.329999999999998 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' HD21 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 71.099999999999994 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.439999999999998 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 72.409999999999997 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 72.140000000000001 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.420000000000002 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.239999999999995 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.519999999999996 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 64.310000000000002 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.43 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 60.509999999999998 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 51.039999999999999 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 64.25 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.439999999999998 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 73.200000000000003 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 94' ' ' GLN . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.130000000000003 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.319999999999993 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 70.209999999999994 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.310000000000002 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 62.310000000000002 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 72.319999999999993 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.510000000000005 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.140000000000001 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.537 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 54.43 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.409999999999997 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 71.439999999999998 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.040000000000006 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.340000000000003 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.408 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.530000000000001 109.9 -175.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.646 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.530000000000001 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.099999999999994 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.049999999999997 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.409999999999997 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.43 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.350000000000001 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.010000000000005 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.030000000000001 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 71.109999999999999 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.576 ' CA ' HD22 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.299999999999997 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.530000000000001 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.427 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 70.310000000000002 109.125 172.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 64.430000000000007 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.239999999999995 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.463 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.549999999999997 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.486 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.510000000000005 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 61.25 110.699 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.498 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 63.439999999999998 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.875 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.109999999999999 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.530000000000001 109.735 178.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.875 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.219999999999999 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.340000000000003 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.605 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.230000000000004 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.299999999999997 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.487 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 71.230000000000004 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.591 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.329999999999998 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 73.329999999999998 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.409999999999997 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 74.540000000000006 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.703 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.010000000000005 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 64.510000000000005 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.439999999999998 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.519999999999996 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.239999999999995 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 22.43 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 10.2 p80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.450000000000003 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.150000000000006 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 63.219999999999999 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.417 ' HG ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 61.32 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.450000000000003 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 60.140000000000001 110.287 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.605 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 71.219999999999999 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.150000000000006 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.400000000000006 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.409999999999997 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.631 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.219999999999999 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.349999999999994 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 61.130000000000003 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 116' ' ' LEU . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 61.130000000000003 110.699 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.420000000000002 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.040000000000006 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.424 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 62.119999999999997 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.230000000000004 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 60.43 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.420000000000002 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 120.882 0.372 . . . . 74.140000000000001 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 74.310000000000002 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.409999999999997 109.124 172.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' HD12 ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 64.219999999999999 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 63.219999999999999 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.25 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.310000000000002 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.468 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 61.549999999999997 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 63.43 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 64.140000000000001 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.409999999999997 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.562 ' HB2' HG23 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.329999999999998 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.614 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.420000000000002 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.109999999999999 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.230000000000004 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.561 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.400000000000006 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 62.119999999999997 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 61.0 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.723 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 64.030000000000001 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.439999999999998 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 71.120000000000005 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.140000000000001 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.429 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.549999999999997 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 71.040000000000006 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.409999999999997 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.129999999999995 109.019 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 63.340000000000003 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 73.340000000000003 110.013 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 64.129999999999995 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.150000000000006 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.140000000000001 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.540000000000006 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.549999999999997 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.429 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 73.319999999999993 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.562 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 52.409999999999997 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 61.520000000000003 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.450000000000003 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.604 HD11 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.510000000000005 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.239999999999995 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 60.509999999999998 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.129999999999995 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.450000000000003 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.25 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 54.539999999999999 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 74.519999999999996 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.349999999999994 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 73.25 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.435 ' HB3' HG23 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 74.150000000000006 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 71.450000000000003 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 63.310000000000002 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 71.530000000000001 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 63.130000000000003 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.435 HG23 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.010000000000005 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.030000000000001 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 72.340000000000003 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 43.450000000000003 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.430000000000007 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.099999999999994 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.403 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.120000000000005 109.182 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.299999999999997 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.409999999999997 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 73.430000000000007 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.409999999999997 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.010000000000005 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.604 ' HA2' HD11 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 42.340000000000003 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.409999999999997 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.562 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 63.420000000000002 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.010000000000005 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.518 ' HG2' ' HG3' ' A' ' 80' ' ' MET . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.310000000000002 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.518 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.239999999999995 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.519999999999996 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 63.420000000000002 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.466 ' H ' ' CB ' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 54.109999999999999 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 73.150000000000006 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.129999999999995 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.439999999999998 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.319999999999993 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.509 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.200000000000003 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.200000000000003 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.109999999999999 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.487 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.430000000000007 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.340000000000003 110.508 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.109999999999999 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.427 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.120000000000005 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.140000000000001 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.439999999999998 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 61.210000000000001 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.120000000000005 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.429 ' HB2' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 65.420000000000002 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.010000000000005 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.230000000000004 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.349999999999994 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.150000000000006 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 71.430000000000007 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 63.340000000000003 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 54.039999999999999 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 61.310000000000002 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.509 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 72.230000000000004 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.100000000000001 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.510000000000005 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 64.540000000000006 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.531 ' HA ' HD22 ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.030000000000001 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.687 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 64.019999999999996 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 73.549999999999997 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.340000000000003 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.605 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.549999999999997 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.219999999999999 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 70.310000000000002 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 34.0 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 70.25 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.430000000000007 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.531 0.238 0 CA-C-O 121.099 0.476 . . . . 63.509999999999998 110.605 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 72.310000000000002 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 73.430000000000007 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 72.340000000000003 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.475 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 55.350000000000001 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.040000000000006 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.439999999999998 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.239999999999995 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.430000000000007 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 61.409999999999997 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 65.340000000000003 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.507 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.430000000000007 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.735 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 62.25 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.735 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 53.43 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 64.319999999999993 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.428 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.400000000000006 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.400000000000006 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.219999999999999 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 63.149999999999999 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 55.32 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 40' ' ' GLN . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.150000000000006 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.329999999999998 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.540000000000006 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.109999999999999 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.230000000000004 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.458 ' H ' HD12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 53.009999999999998 110.384 -175.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 71.420000000000002 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.818 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.349999999999994 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 72.349999999999994 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.400000000000006 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.893 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 65.140000000000001 110.292 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.439999999999998 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 70.409999999999997 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 73.430000000000007 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.574 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.543 ' HG2' ' HB3' ' A' ' 24' ' ' GLU . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.439999999999998 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.109999999999999 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.120000000000005 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.540000000000006 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.409999999999997 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 71.530000000000001 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.439999999999998 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 53.039999999999999 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 43.119999999999997 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 72.209999999999994 110.108 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.594 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 54.450000000000003 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.340000000000003 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 72.140000000000001 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.239999999999995 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.492 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 73.030000000000001 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.219999999999999 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 72.140000000000001 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 73.319999999999993 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.230000000000004 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.492 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.230000000000004 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.150000000000006 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 65' ' ' TYR . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 71.299999999999997 110.49 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.209999999999994 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.140000000000001 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 71.140000000000001 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.431 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 72.150000000000006 111.26 -176.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 73.109999999999999 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.421 ' HB2' ' HE3' ' A' ' 78' ' ' MET . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.299999999999997 111.479 -169.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.219999999999999 109.702 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 62.210000000000001 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.32 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.530000000000001 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 63.200000000000003 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.310000000000002 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 34.350000000000001 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 73.319999999999993 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.574 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 71.230000000000004 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.549999999999997 110.614 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.544 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.030000000000001 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.040000000000006 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.540000000000006 112.598 -172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.569 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.310000000000002 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 73.230000000000004 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 73.030000000000001 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.523 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.150000000000006 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.200000000000003 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.523 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 55.329999999999998 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.540000000000006 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.450000000000003 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.209999999999994 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 72.239999999999995 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.310000000000002 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 65.129999999999995 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.495 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 61.520000000000003 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.010000000000005 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.594 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.439999999999998 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.150000000000006 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.150000000000006 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.401 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 64.010000000000005 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 43.32 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.230000000000004 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.129999999999995 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 50.509999999999998 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.230000000000004 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.446 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.319999999999993 108.968 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.109999999999999 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 55.229999999999997 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.540000000000006 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.329999999999998 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.409999999999997 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 73.230000000000004 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 64.109999999999999 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.319999999999993 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.200000000000003 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 29' ' ' ILE . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 63.409999999999997 110.513 177.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.349999999999994 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.310000000000002 111.489 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.319999999999993 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 50.0 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.818 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 61.439999999999998 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 50.020000000000003 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.099 0.476 . . . . 70.420000000000002 110.485 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.439999999999998 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 64.129999999999995 111.328 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.200000000000003 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.340000000000003 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.559 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.239999999999995 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 65.299999999999997 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 64.140000000000001 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.230000000000004 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.420000000000002 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.409999999999997 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.200000000000003 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.310000000000002 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 51.409999999999997 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 73.519999999999996 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 64.129999999999995 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 72.239999999999995 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.230000000000004 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 73.120000000000005 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.71 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.340000000000003 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 70.310000000000002 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 71.200000000000003 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 64.409999999999997 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.530000000000001 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.645 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.420000000000002 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.010000000000005 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 62.100000000000001 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.299999999999997 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 73.299999999999997 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.559 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 62.009999999999998 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.71 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.319999999999993 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.530000000000001 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 55.439999999999998 110.21 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.019999999999996 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.349999999999994 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.319999999999993 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.420000000000002 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 71.409999999999997 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 61.130000000000003 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.430000000000007 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.030000000000001 109.169 172.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.68 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.310000000000002 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 71.340000000000003 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 72.25 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 61.409999999999997 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.239999999999995 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.040000000000006 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 59' ' ' ILE . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.209999999999994 109.268 173.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 t-20 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.430000000000007 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.510000000000005 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 65.109999999999999 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.019999999999996 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.406 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 73.25 112.126 -173.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.019999999999996 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.409999999999997 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.200000000000003 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 65.120000000000005 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.701 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 65.200000000000003 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.573 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.439999999999998 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HB2' ' A' ' 61' ' ' GLU . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 65.129999999999995 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.51 ' HD1' ' CD ' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.329999999999998 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.239999999999995 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.319999999999993 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 70.030000000000001 109.726 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.409999999999997 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.450000000000003 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.329999999999998 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 64.209999999999994 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 62.229999999999997 110.001 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CD ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.519999999999996 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.603 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 64.310000000000002 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.230000000000004 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 31.239999999999998 111.74 -178.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.439999999999998 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.510000000000005 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 26.9 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.120000000000005 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.109999999999999 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.439999999999998 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.701 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.53 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.109999999999999 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.150000000000006 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.010000000000005 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.629 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.219999999999999 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 73.219999999999999 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.200000000000003 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.150000000000006 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 71.439999999999998 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 73.439999999999998 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 43.329999999999998 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.420000000000002 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.140000000000001 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.431 HG22 ' HA ' ' A' ' 96' ' ' GLN . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.340000000000003 111.296 177.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.219999999999999 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.430000000000007 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 52.200000000000003 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 62.210000000000001 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 72.239999999999995 108.849 -178.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.439999999999998 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.299999999999997 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.53 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 73.209999999999994 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 34.32 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.329999999999998 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 63.109999999999999 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.030000000000001 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 74.540000000000006 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.450000000000003 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 70.519999999999996 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.512 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.329999999999998 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 118' ' ' LYS . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.319999999999993 111.079 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 65.200000000000003 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 42.229999999999997 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 65.430000000000007 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 71.150000000000006 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm . . . . . 0 N--CA 1.461 0.124 0 N-CA-C 112.614 0.598 . . . . 72.120000000000005 112.614 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 61.240000000000002 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 72.310000000000002 111.353 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.200000000000003 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.420000000000002 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 63.109999999999999 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 62.149999999999999 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.039999999999999 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 71.400000000000006 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.548 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.239999999999995 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.319999999999993 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.729 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 74.409999999999997 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 64.200000000000003 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.130000000000003 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 60.340000000000003 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 63.219999999999999 109.741 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 53.219999999999999 113.128 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 23' ' ' SER . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 54.25 109.203 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.140000000000001 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 53.299999999999997 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.200000000000003 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 61.200000000000003 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.310000000000002 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 55.409999999999997 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.418 HD13 ' HB3' ' A' ' 116' ' ' LEU . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 71.510000000000005 110.898 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.240000000000002 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.019999999999996 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 63.119999999999997 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 34.119999999999997 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.721 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 72.340000000000003 110.292 178.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.510000000000005 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.319999999999993 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.507 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 71.430000000000007 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.519999999999996 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.219999999999999 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.310000000000002 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.492 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 71.010000000000005 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.492 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 70.430000000000007 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.841 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 60.229999999999997 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 70.140000000000001 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 61.149999999999999 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.349999999999994 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 63.25 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 64.129999999999995 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.140000000000001 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.462 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 65.25 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 71.219999999999999 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.804 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 73.530000000000001 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 71.239999999999995 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.219999999999999 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.340000000000003 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 73.349999999999994 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.340000000000003 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.457 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.409999999999997 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 70.209999999999994 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 54.539999999999999 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.430000000000007 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.209999999999994 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.230000000000004 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.040000000000006 109.414 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.140000000000001 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.450000000000003 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 71.230000000000004 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 65.340000000000003 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.140000000000001 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.841 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 63.340000000000003 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 73.530000000000001 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 34.409999999999997 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 62.0 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 72.099999999999994 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 72.340000000000003 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 72.209999999999994 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 51.409999999999997 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.049999999999997 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.43 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.209999999999994 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 44.32 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.299999999999997 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.219999999999999 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 52.140000000000001 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.209999999999994 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.239999999999995 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.310000000000002 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.200000000000003 109.54 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.430000000000007 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.430000000000007 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 70.409999999999997 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.804 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 60.049999999999997 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.119999999999997 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.349999999999994 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.099999999999994 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.120000000000005 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.430000000000007 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.040000000000006 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.340000000000003 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.329999999999998 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.329999999999998 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.209999999999994 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 60.439999999999998 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.319999999999993 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 63.310000000000002 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 64.230000000000004 108.756 177.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.409999999999997 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 63.229999999999997 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 63.399999999999999 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.200000000000003 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.209999999999994 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.010000000000005 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.310000000000002 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 61.229999999999997 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.418 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.310000000000002 110.023 177.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.409999999999997 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 62.420000000000002 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.310000000000002 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 61.109999999999999 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.340000000000003 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.120000000000005 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.463 0.207 0 N-CA-C 112.004 0.372 . . . . 70.540000000000006 112.004 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.581 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 71.129999999999995 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 64.450000000000003 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.637 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 63.130000000000003 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.010000000000005 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.109999999999999 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 72.340000000000003 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 64.349999999999994 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 64.319999999999993 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.120000000000005 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.420000000000002 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.636 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.129999999999995 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.96 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.420000000000002 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.96 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 65.030000000000001 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.675 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 72.230000000000004 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 43.329999999999998 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.099999999999994 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.099999999999994 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.140000000000001 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 43.450000000000003 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.239999999999995 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.669 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 61.539999999999999 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.534 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 65.510000000000005 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.450000000000003 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.933 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 73.420000000000002 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.310000000000002 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 52.210000000000001 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.420000000000002 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.409999999999997 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.722 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.510000000000005 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 72.310000000000002 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.549999999999997 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.441 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 71.299999999999997 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 73.400000000000006 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.744 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 54.219999999999999 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 62.25 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 74.230000000000004 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.530000000000001 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.409999999999997 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.519999999999996 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.634 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 53.420000000000002 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.150000000000006 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.519999999999996 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.109999999999999 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.534 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 64.109999999999999 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.633 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 72.420000000000002 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 63.200000000000003 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.329999999999998 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 61.409999999999997 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 61.409999999999997 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.420000000000002 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 64.200000000000003 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.329999999999998 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.109999999999999 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 50.539999999999999 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.763 ' HG3' ' HB3' ' A' ' 87' ' ' ASP . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 65.040000000000006 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 71.219999999999999 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 65.349999999999994 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.130000000000003 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 64.209999999999994 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.430000000000007 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.219999999999999 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 63.229999999999997 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.130000000000003 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 25.420000000000002 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 71.25 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.441 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 72.510000000000005 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 60.530000000000001 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.624 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.299999999999997 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 64.430000000000007 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.140000000000001 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.755 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 71.230000000000004 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.030000000000001 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.010000000000005 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.040000000000006 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.763 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.310000000000002 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.43 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.219999999999999 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.575 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 62.240000000000002 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 71.120000000000005 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.43 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 71.030000000000001 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.633 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 61.200000000000003 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.534 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.200000000000003 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.129999999999995 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.458 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.120000000000005 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.340000000000003 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.219999999999999 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.644 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.439999999999998 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.209999999999994 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.240000000000002 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.531 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.120000000000005 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 44.329999999999998 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 71.510000000000005 108.783 177.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.430000000000007 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.575 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 44.100000000000001 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.019999999999996 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.340000000000003 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.57 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 73.329999999999998 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 64.420000000000002 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 64.329999999999998 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 51.119999999999997 110.822 -179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.933 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.030000000000001 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.540000000000006 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 72.030000000000001 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.439999999999998 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 73.319999999999993 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.310000000000002 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.234 0.238 0 N-CA-C 112.518 0.562 . . . . 74.109999999999999 112.518 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.209999999999994 110.864 -178.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 65.219999999999999 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.209999999999994 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.230000000000004 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.400000000000006 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.340000000000003 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 52.549999999999997 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.540000000000006 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.450000000000003 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.140000000000001 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 72.219999999999999 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.529 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.349999999999994 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.529 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.340000000000003 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.129999999999995 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.789 HG21 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 72.109999999999999 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.530000000000001 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.510000000000005 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.441 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.420000000000002 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.678 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.430000000000007 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.789 ' HB2' HG21 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 44.229999999999997 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 72.019999999999996 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.239999999999995 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 70.420000000000002 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 53.350000000000001 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.597 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 71.329999999999998 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 71.319999999999993 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.450000000000003 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.651 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 65.030000000000001 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 71.400000000000006 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 62.450000000000003 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.219999999999999 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.030000000000001 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 72.230000000000004 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.414 ' HE1' ' HG2' ' A' ' 28' ' ' GLU . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.349999999999994 111.203 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 62.420000000000002 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.530000000000001 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.209999999999994 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.230000000000004 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.230000000000004 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.409999999999997 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.319999999999993 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.129999999999995 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 54.340000000000003 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.120000000000005 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.230000000000004 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 61.229999999999997 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.109999999999999 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.444 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.140000000000001 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 65.430000000000007 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HB2' HD13 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 71.430000000000007 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 64.129999999999995 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HA ' HG23 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 71.439999999999998 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.319999999999993 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.593 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 74.349999999999994 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.219999999999999 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.239999999999995 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.329999999999998 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.446 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.150000000000006 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.099999999999994 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 72.219999999999999 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.613 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.400000000000006 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 64.340000000000003 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 73.209999999999994 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.019999999999996 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' A' ' 75' ' ' ILE . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.040000000000006 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.010000000000005 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.44 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.519999999999996 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 44.509999999999998 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.44 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.099999999999994 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.420000000000002 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.409999999999997 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.613 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 62.32 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 54.340000000000003 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 73.450000000000003 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 74.010000000000005 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.140000000000001 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 71.540000000000006 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.140000000000001 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 64.340000000000003 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 74.140000000000001 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 54.229999999999997 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 64.340000000000003 107.502 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.578 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.319999999999993 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 65.340000000000003 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.109999999999999 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.628 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.239999999999995 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 70.219999999999999 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.329999999999998 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 65.409999999999997 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.420000000000002 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.678 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.299999999999997 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 71.010000000000005 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 61.509999999999998 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 72.040000000000006 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 73.319999999999993 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.040000000000006 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 71.219999999999999 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.340000000000003 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 63.299999999999997 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.230000000000004 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 73.120000000000005 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.049999999999997 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.578 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 64.530000000000001 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.219999999999999 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.632 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.420000000000002 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.109999999999999 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.525 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.109999999999999 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 74.349999999999994 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 53.539999999999999 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 72.239999999999995 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.574 ' N ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 50.399999999999999 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 63.149999999999999 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.420000000000002 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.597 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 65.329999999999998 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 63.009999999999998 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.319999999999993 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 CA--C 1.522 -0.106 0 CA-C-O 120.963 0.411 . . . . 74.140000000000001 110.719 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 74.310000000000002 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.409999999999997 110.252 176.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 64.219999999999999 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 63.219999999999999 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.25 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.310000000000002 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 61.549999999999997 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 63.43 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 64.140000000000001 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.409999999999997 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.329999999999998 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.496 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.420000000000002 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.109999999999999 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.230000000000004 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.400000000000006 110.144 173.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 62.119999999999997 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 61.0 108.508 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 64.030000000000001 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.439999999999998 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.427 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 71.120000000000005 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.616 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.140000000000001 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.485 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.409999999999997 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.549999999999997 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 71.040000000000006 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.409999999999997 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.129999999999995 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 63.340000000000003 112.113 -174.02 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 64.129999999999995 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.42 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.150000000000006 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.140000000000001 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.488 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.540000000000006 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.549999999999997 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 73.319999999999993 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 52.409999999999997 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 61.520000000000003 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.450000000000003 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.319999999999993 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.510000000000005 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.239999999999995 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 60.509999999999998 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.129999999999995 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.450000000000003 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.25 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 54.539999999999999 109.869 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 74.519999999999996 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 59' ' ' ILE . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.349999999999994 108.814 173.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.46 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 73.25 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 74.150000000000006 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 71.450000000000003 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HA ' HG23 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 63.310000000000002 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 71.530000000000001 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 63.130000000000003 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 64.040000000000006 111.029 -176.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 67' ' ' MET . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.010000000000005 110.319 -176.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.030000000000001 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 72.340000000000003 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.513 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 43.450000000000003 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.430000000000007 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.099999999999994 109.582 171.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.484 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.120000000000005 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.299999999999997 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.409999999999997 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.411 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.991 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.010000000000005 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 42.340000000000003 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.409999999999997 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 63.420000000000002 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.63 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.010000000000005 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.129999999999995 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.310000000000002 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.43 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.239999999999995 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.519999999999996 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.019999999999996 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 63.420000000000002 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 54.109999999999999 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 73.150000000000006 109.662 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.129999999999995 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.513 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.439999999999998 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.319999999999993 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.504 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.200000000000003 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.200000000000003 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.109999999999999 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.430000000000007 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.481 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.340000000000003 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.109999999999999 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.120000000000005 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.439999999999998 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 61.210000000000001 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.120000000000005 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 65.420000000000002 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.010000000000005 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.230000000000004 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' HIS . . . . . 0.481 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.349999999999994 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.150000000000006 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.408 ' HG ' ' HG ' ' A' ' 108' ' ' LEU . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 63.340000000000003 110.669 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' VAL . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 54.039999999999999 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 61.310000000000002 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . 0.504 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 72.230000000000004 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.100000000000001 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . 0.637 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.510000000000005 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 64.540000000000006 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HA ' HD22 ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.030000000000001 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 64.019999999999996 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 73.549999999999997 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.417 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.340000000000003 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.409 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.549999999999997 111.765 -176.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.219999999999999 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 70.310000000000002 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 34.0 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 70.25 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.430000000000007 110.289 -177.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.726 0.298 . . . . 73.310000000000002 110.673 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -166.59 -56.25 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.803 -0.635 . . . . 65.340000000000003 109.319 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.526 ' OE1' ' HD2' ' A' ' 66' ' ' LYS . 25.2 mm-40 -74.51 83.62 2.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.547 -0.751 . . . . 63.149999999999999 111.362 178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.9 ttm -76.51 -31.46 57.71 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.511 -0.551 . . . . 61.399999999999999 109.511 173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.492 ' HA ' HD23 ' A' ' 8' ' ' LEU . 55.5 mtpt -61.01 -29.19 69.56 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.592 -0.731 . . . . 73.549999999999997 110.9 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -62.84 -30.23 71.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.261 -0.427 . . . . 74.25 110.861 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.5 mt -67.14 -26.59 66.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.321 -0.4 . . . . 65.349999999999994 110.899 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 5' ' ' LYS . 3.7 mm? -74.53 -27.45 60.53 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.271 -0.422 . . . . 73.010000000000005 110.769 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.734 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -80.24 -22.96 41.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.979 0.419 . . . . 43.43 110.423 178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.1 tt -59.61 129.36 41.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.607 -0.724 . . . . 52.229999999999997 110.731 -179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.499 ' HB3' ' CD1' ' A' ' 38' ' ' TRP . 22.9 t -148.88 154.7 39.84 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.391 -0.966 . . . . 71.540000000000006 108.391 176.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -92.45 155.21 18.01 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.962 0.411 . . . . 75.319999999999993 111.421 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 4.8 pt-20 -60.91 115.46 3.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.503 -0.771 . . . . 74.239999999999995 110.328 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -127.45 -59.69 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 111.884 -172.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 8.9 ptmm? -71.09 106.82 3.87 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.589 0.709 . . . . 50.25 111.611 -178.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.709 ' N ' ' HD2' ' A' ' 17' ' ' PRO . 89.3 t80 -110.51 -36.91 0.12 Allowed Pre-proline 0 CA--C 1.552 1.042 0 N-CA-C 114.248 1.203 . . . . 73.439999999999998 114.248 -176.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.709 ' HD2' ' N ' ' A' ' 16' ' ' PHE . 53.0 Cg_exo -14.45 -77.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.917 1 C-N-CA 125.683 4.256 . . . . 63.149999999999999 117.181 -167.495 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 26.5 m -137.51 104.17 5.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.184 0.439 . . . . 75.329999999999998 112.184 -173.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.634 HG11 ' HG2' ' A' ' 24' ' ' GLU . 29.1 m -136.63 139.65 29.87 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.104 -0.498 . . . . 73.219999999999999 109.898 172.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.25 -62.72 0.03 OUTLIER 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.689 2.259 . . . . 72.319999999999993 111.945 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.43 HG22 ' H ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -85.31 -173.14 4.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.867 -0.606 . . . . 61.310000000000002 109.599 178.088 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 34.6 mmtp -107.18 19.33 20.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.264 0.554 . . . . 64.129999999999995 109.569 175.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.702 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 3.7 m -98.47 84.4 3.18 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 115.095 -0.957 . . . . 62.030000000000001 108.738 178.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.634 ' HG2' HG11 ' A' ' 19' ' ' VAL . 0.4 OUTLIER -98.95 138.62 35.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.675 -1.148 . . . . 75.409999999999997 110.957 -169.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.705 HD23 HD11 ' A' ' 95' ' ' ILE . 1.2 tm? -108.11 109.78 21.29 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.24 -0.652 . . . . 43.130000000000003 109.24 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.19 122.6 48.28 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.006 0.432 . . . . 44.119999999999997 111.676 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 90.7 t -128.21 123.88 61.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.662 -0.699 . . . . 73.109999999999999 110.245 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 38.7 tt0 -116.59 139.35 50.6 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.323 -0.621 . . . . 72.450000000000003 109.323 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 67.5 mt -112.75 129.1 68.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.962 0.41 . . . . 75.319999999999993 111.818 -171.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.821 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 93.5 mt -111.85 150.99 29.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.567 -0.742 . . . . 70.299999999999997 109.438 174.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.705 ' HB3' ' HB2' ' A' ' 121' ' ' GLU . 12.9 pt-20 -71.19 -14.22 62.19 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.694 0.283 . . . . 71.049999999999997 111.718 -172.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 52.3 mtpt -79.71 18.49 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.724 179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 63.22 48.68 77.38 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 110.646 -0.982 . . . . 62.350000000000001 110.646 -174.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.821 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -117.69 118.56 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.827 0.346 . . . . 74.450000000000003 110.625 -176.226 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.5 t -95.93 118.81 42.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 115.6 -0.727 . . . . 72.099999999999994 109.98 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.565 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 5.1 tpt180 -95.94 108.69 21.1 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 107.358 -1.349 . . . . 73.340000000000003 107.358 173.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.534 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 62.4 t80 -125.31 120.81 32.19 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.871 0.367 . . . . 75.0 110.959 -173.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.499 ' CD1' ' HB3' ' A' ' 11' ' ' SER . 57.3 p-90 -150.42 146.47 26.69 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.837 -0.619 . . . . 74.109999999999999 109.435 171.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.58 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 6.1 ptm -134.89 151.26 50.74 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.09 -0.505 . . . . 75.129999999999995 110.136 177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.702 ' O ' ' HA ' ' A' ' 23' ' ' SER . 64.1 tt0 -130.35 154.11 48.01 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.516 -0.55 . . . . 71.519999999999996 109.516 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -136.77 156.75 48.1 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.086 -0.339 . . . . 62.340000000000003 110.086 176.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 10.2 pt-20 -84.48 -25.6 28.77 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.091 0.472 . . . . 65.109999999999999 110.786 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -119.92 132.93 55.69 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.701 -0.851 . . . . 75.450000000000003 108.701 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.2 mt -109.29 -60.46 1.76 Allowed 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.87 0.367 . . . . 73.310000000000002 111.326 -169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.0 m -67.63 124.49 23.41 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.362 -0.381 . . . . 55.439999999999998 110.714 -178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 p 54.45 39.35 30.97 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.852 0.861 . . . . 71.209999999999994 111.577 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -147.59 146.39 29.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.058 -0.519 . . . . 70.400000000000006 110.71 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 68.29 97.01 0.06 Allowed 'General case' 0 N--CA 1.463 0.187 0 O-C-N 124.07 0.856 . . . . 72.540000000000006 111.802 178.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -99.56 119.81 38.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.441 -0.578 . . . . 72.329999999999998 109.441 175.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.458 HG21 ' SD ' ' A' ' 39' ' ' MET . 17.8 t -104.86 114.62 44.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.777 -0.647 . . . . 73.409999999999997 110.917 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.408 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 51.7 m -83.99 105.1 14.6 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.082 -0.508 . . . . 63.549999999999997 109.909 175.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.567 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 69.1 m-85 -79.18 81.91 5.39 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.242 -0.651 . . . . 70.430000000000007 109.242 176.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.5 mm -95.3 113.16 29.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.825 -0.625 . . . . 72.319999999999993 112.082 -171.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -117.61 114.32 23.23 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.959 -0.756 . . . . 72.239999999999995 108.959 169.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 62.2 30.84 17.74 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.359 0.6 . . . . 70.299999999999997 110.065 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HA ' HG23 ' A' ' 53' ' ' ILE . 45.7 mt-10 70.28 22.71 5.32 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.094 -0.957 . . . . 75.040000000000006 111.643 -179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -127.37 140.03 52.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.518 -0.765 . . . . 74.140000000000001 108.96 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 26.7 mt-10 -78.11 136.87 37.95 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.345 -0.542 . . . . 64.329999999999998 110.856 177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.4 pt -109.51 156.67 10.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-N 115.261 -0.882 . . . . 74.530000000000001 111.686 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -127.44 160.97 29.83 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.228 -0.896 . . . . 72.310000000000002 109.674 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.561 ' OE1' ' HD3' ' A' ' 66' ' ' LYS . 29.2 tt0 -66.58 143.26 57.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.149 0.499 . . . . 74.430000000000007 111.187 -177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -167.75 -131.08 1.24 Allowed Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.753 -0.658 . . . . 72.439999999999998 111.686 -179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.53 -59.45 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.698 2.266 . . . . 71.420000000000002 112.378 178.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.641 ' HG3' ' HB2' ' A' ' 83' ' ' LEU . 4.0 tmmm? -88.78 -22.63 23.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 73.120000000000005 110.741 -174.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 93.7 m-85 -102.18 130.77 48.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.426 -0.352 . . . . 75.420000000000002 110.923 -177.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.561 ' HD3' ' OE1' ' A' ' 61' ' ' GLU . 17.3 tppt? -138.01 117.57 12.98 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.268 -0.641 . . . . 74.400000000000006 109.268 178.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.494 ' HB2' ' HE2' ' A' ' 78' ' ' MET . 12.9 tmm? -150.16 131.26 14.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.847 0.356 . . . . 74.129999999999995 110.88 -173.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -131.82 168.13 18.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.264 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.671 HG13 HG12 ' A' ' 76' ' ' ILE . 10.6 tt -133.2 120.13 38.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-O 121.228 0.537 . . . . 73.040000000000006 111.246 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.433 ' HB3' ' O ' ' A' ' 75' ' ' ILE . 1.1 t70 -87.83 145.21 26.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 74.439999999999998 110.584 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 80.2 mtt180 -119.54 4.81 11.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.133 -0.485 . . . . 72.310000000000002 111.557 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.418 HD22 ' HA ' ' A' ' 72' ' ' ASN . 0.6 OUTLIER -97.79 -32.13 11.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.205 0.526 . . . . 74.510000000000005 110.549 -177.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.425 ' HB ' HG12 ' A' ' 75' ' ' ILE . 1.7 m -121.89 -28.82 4.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.769 -0.65 . . . . 62.240000000000002 110.021 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.555 ' O ' ' HA ' ' A' ' 40' ' ' GLN . . . 103.2 27.37 6.56 Favored Glycine 0 N--CA 1.444 -0.815 0 CA-C-N 115.248 -0.887 . . . . 71.310000000000002 111.764 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 77' ' ' GLU . 43.2 mm -93.59 110.23 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.896 0.379 . . . . 74.409999999999997 111.022 -177.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.671 HG12 HG13 ' A' ' 69' ' ' ILE . 58.2 mt -99.41 110.2 26.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 108.559 -0.904 . . . . 53.210000000000001 108.559 171.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.502 ' HG3' HG22 ' A' ' 75' ' ' ILE . 0.0 OUTLIER -112.58 145.09 40.96 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.472 0.653 . . . . 71.530000000000001 112.021 -173.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.534 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 49.2 ttm -136.18 136.12 39.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.25 -0.886 . . . . 74.299999999999997 109.899 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.734 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 35.4 t80 -120.31 114.38 21.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.253 -0.43 . . . . 75.349999999999994 110.25 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 37.2 mtp -104.73 131.77 51.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.038 -0.528 . . . . 73.349999999999994 110.936 177.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 82' ' ' LYS . 2.6 pt-20 -97.94 -92.52 0.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.436 -0.802 . . . . 72.420000000000002 110.104 175.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 177.23 152.05 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.278 -0.638 . . . . 71.120000000000005 109.278 171.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.641 ' HB2' ' HG3' ' A' ' 64' ' ' LYS . 38.4 tp -117.74 -73.02 0.66 Allowed 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.838 -0.43 . . . . 71.409999999999997 109.838 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.475 ' HB3' ' HG2' ' A' ' 86' ' ' GLU . 29.3 mm-40 -149.29 156.22 41.76 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.061 -0.518 . . . . 71.310000000000002 109.618 -179.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -61.12 -27.65 68.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.121 0.486 . . . . 74.430000000000007 110.336 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 12.6 pt-20 -76.62 -28.42 56.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.519 -0.764 . . . . 44.340000000000003 111.708 178.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -89.47 -41.61 11.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.984 0.421 . . . . 52.140000000000001 110.494 -174.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.547 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.2 OUTLIER -58.21 129.47 42.15 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.427 -0.806 . . . . 64.230000000000004 110.55 176.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.542 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -140.56 -152.19 5.74 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.927 -0.654 . . . . 71.209999999999994 112.822 -175.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.2 m -87.64 109.76 19.9 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.959 0.409 . . . . 74.439999999999998 110.5 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.469 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 84.7 m-85 -97.37 121.68 39.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.036 -0.529 . . . . 72.430000000000007 109.661 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.587 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 56.7 m -126.75 105.08 8.43 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.379 0.609 . . . . 64.530000000000001 110.301 -177.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -99.38 117.59 34.14 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.755 -0.657 . . . . 72.239999999999995 109.635 -179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.408 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 10.6 pt20 -125.75 116.52 21.74 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.374 0.607 . . . . 74.530000000000001 111.061 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.705 HD11 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.83 110.5 21.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.303 -0.862 . . . . 64.010000000000005 109.074 174.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -92.92 99.19 11.88 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.994 -0.743 . . . . 72.230000000000004 108.994 178.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -132.79 106.76 7.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.79 -0.641 . . . . 60.329999999999998 111.168 -173.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.51 -111.74 4.37 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.543 -0.753 . . . . 63.109999999999999 112.357 177.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -116.57 11.08 14.66 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.796 0.331 . . . . 71.030000000000001 110.94 -179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -122.96 139.39 54.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.781 0.324 . . . . 63.039999999999999 110.643 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 41.6 p -107.77 113.13 26.17 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.033 0.444 . . . . 62.32 110.893 177.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.77 77.99 1.83 Allowed Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 110.291 -1.123 . . . . 71.310000000000002 110.291 174.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -102.71 131.72 49.34 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.102 0.477 . . . . 61.420000000000002 111.557 -171.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 24.0 t -137.71 116.8 12.52 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.714 -0.675 . . . . 64.439999999999998 109.948 174.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.1 m -98.21 117.42 32.55 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.611 -0.514 . . . . 75.25 109.611 175.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.422 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -127.7 100.59 6.02 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.078 -0.712 . . . . 71.239999999999995 109.078 -177.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -100.22 115.0 40.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.397 0.618 . . . . 52.219999999999999 111.113 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 79.2 mt -118.68 103.51 9.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.824 -0.625 . . . . 72.109999999999999 109.412 175.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.542 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.8 mt -144.99 126.22 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 110.2 -0.296 . . . . 63.420000000000002 110.2 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 43.59 -119.38 2.52 Favored Glycine 0 CA--C 1.52 0.346 0 O-C-N 123.835 0.709 . . . . 71.349999999999994 114.454 174.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.586 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 37.9 t70 -74.94 -24.06 58.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.047 0.451 . . . . 73.239999999999995 111.281 -177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.6 t -59.23 -44.17 91.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 111.364 -175.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.656 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 3.7 p90 -71.53 -26.75 62.78 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.052 -0.659 . . . . 63.0 112.725 -175.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -67.32 -29.77 69.43 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.4 -0.52 . . . . 75.030000000000001 109.621 -179.391 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.428 ' HB2' ' HE3' ' A' ' 115' ' ' LYS . 36.5 ttmt -64.84 -55.38 19.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.321 -0.854 . . . . 74.219999999999999 110.602 -179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -68.63 -32.59 72.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.846 -0.615 . . . . 75.25 110.785 -179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.514 HE21 ' CA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -62.05 -44.74 96.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 55.43 110.91 -179.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 12.9 mmmm -74.43 -21.96 59.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.272 -0.422 . . . . 72.120000000000005 112.074 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 37.5 mt-10 -76.57 -19.35 57.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 62.210000000000001 110.526 178.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.72 -52.55 4.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.994 -0.548 . . . . 64.400000000000006 109.929 174.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.705 ' HB2' ' HB3' ' A' ' 31' ' ' GLU . 15.2 mm-40 -111.02 97.54 6.89 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.662 -0.699 . . . . 75.430000000000007 110.268 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 29.2 p90 . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.432 -0.794 . . . . 72.340000000000003 110.218 -178.778 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 109.715 -0.476 . . . . 74.25 109.715 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.6 tt0 -130.68 135.18 47.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.43 -177.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.83 111.19 2.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.878 -0.601 . . . . 71.120000000000005 110.565 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 70.5 mtm -67.38 -20.73 65.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 75.150000000000006 111.138 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.429 ' HD2' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -58.43 -29.85 66.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.327 0.584 . . . . 52.229999999999997 110.257 177.409 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.547 HH11 ' HB2' ' A' ' 66' ' ' LYS . 10.2 mmt85 -76.92 -15.1 59.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.515 -0.766 . . . . 73.329999999999998 110.891 -174.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 41.4 mt -77.01 -25.51 52.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.457 -0.338 . . . . 64.349999999999994 111.069 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -63.71 -13.0 39.29 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.275 -0.421 . . . . 74.310000000000002 111.349 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.415 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -64.22 -31.51 72.73 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.877 0.37 . . . . 44.140000000000001 111.106 177.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 tt -84.47 90.37 7.6 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.4 t -98.21 47.18 1.0 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.079 -0.51 . . . . 63.25 110.537 -176.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 69.49 147.92 0.07 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.847 -0.615 . . . . 64.109999999999999 111.663 179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.563 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -96.92 141.41 30.14 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.806 -0.633 . . . . 74.340000000000003 110.496 -177.423 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 173.29 28.11 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.329 0.393 . . . . 72.310000000000002 111.429 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.815 ' HG3' ' HB2' ' A' ' 26' ' ' ALA . 69.5 mmtt -82.39 116.12 21.73 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.542 0.687 . . . . 74.040000000000006 111.571 -177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.45 ' C ' ' H ' ' A' ' 18' ' ' THR . 97.0 m-85 -77.56 -34.34 1.15 Allowed Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.874 -1.057 . . . . 74.010000000000005 112.014 175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.429 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 32.1 Cg_exo -66.31 43.31 0.18 Allowed 'Trans proline' 0 C--N 1.364 1.37 0 C-N-CA 122.401 2.067 . . . . 74.109999999999999 112.692 170.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' PHE . 11.9 t -81.16 178.09 8.62 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.552 -0.749 . . . . 61.140000000000001 109.844 178.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.687 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 18.2 m -97.06 164.84 16.99 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.385 -0.598 . . . . 53.030000000000001 109.385 179.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.687 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 42.8 Cg_endo -67.81 52.11 0.52 Allowed 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 123.116 2.544 . . . . 70.109999999999999 113.967 -177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 56.7 m -151.96 -90.33 0.06 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.448 -0.575 . . . . 72.049999999999997 109.448 173.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 42' ' ' GLU . 19.4 mmtt -162.6 14.59 0.08 Allowed 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.439999999999998 110.374 178.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -106.2 99.68 9.25 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.557 -0.747 . . . . 74.319999999999993 110.542 -168.688 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 12.2 pt-20 -92.15 118.58 30.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.569 0.7 . . . . 63.43 111.277 -176.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.427 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.6 tm? -101.26 120.38 40.16 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.31 -0.859 . . . . 60.439999999999998 108.778 178.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.815 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . . . -123.82 135.52 53.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.078 0.466 . . . . 73.310000000000002 112.127 -176.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.6 t -124.32 116.06 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 108.851 -0.796 . . . . 75.230000000000004 108.851 173.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.556 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 12.6 mm-40 -118.19 122.0 41.91 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.11 -0.495 . . . . 73.510000000000005 109.72 -175.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.415 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.3 mp -105.04 125.28 60.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 120.934 0.397 . . . . 71.109999999999999 110.656 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.523 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.9 mm? -105.28 112.11 25.1 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.466 -0.939 . . . . 53.340000000000003 108.466 172.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.553 ' HB2' ' HG3' ' A' ' 117' ' ' GLN . 0.6 OUTLIER -67.78 -14.78 63.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.441 -0.345 . . . . 65.140000000000001 111.132 -169.784 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.9 mtmm -70.19 -11.51 60.94 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.879 -0.6 . . . . 74.329999999999998 111.028 177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 124.87 36.6 0.58 Allowed Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.585 -0.817 . . . . 75.140000000000001 113.715 172.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.523 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 13.1 mm100 -139.39 132.71 30.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 117.307 0.553 . . . . 72.310000000000002 111.332 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.5 t -107.41 116.36 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.617 -0.512 . . . . 53.32 109.617 173.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.556 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 40.7 ttm180 -107.29 110.23 22.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 71.530000000000001 110.162 -178.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -117.27 133.05 56.44 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.972 -0.558 . . . . 72.209999999999994 109.597 179.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.563 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.3 p-90 -150.94 150.82 31.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.112 0.482 . . . . 64.200000000000003 110.925 175.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HB3' HD22 ' A' ' 25' ' ' LEU . 9.3 ptm -143.5 130.4 20.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.656 -0.702 . . . . 73.409999999999997 110.493 -178.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' SER . 48.2 tt0 -111.34 131.88 54.83 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.889 -0.324 . . . . 73.150000000000006 110.551 175.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -106.41 167.75 9.62 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.847 -0.615 . . . . 60.100000000000001 109.361 174.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.415 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . 1.6 pt-20 -89.99 9.76 26.67 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.893 0.378 . . . . 70.049999999999997 110.896 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.669 ' HD3' ' HB3' ' A' ' 47' ' ' ASN . 57.5 mttp -126.86 158.42 36.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.061 -0.518 . . . . 62.109999999999999 110.065 -178.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.5 mt -109.87 -12.09 14.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.787 0.327 . . . . 44.039999999999999 111.006 -176.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 62.6 m -113.47 161.28 17.53 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.087 -0.506 . . . . 73.420000000000002 109.642 175.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 t -70.88 59.85 0.23 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.763 0.792 . . . . 65.239999999999995 111.073 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.669 ' HB3' ' HD3' ' A' ' 43' ' ' LYS . 26.4 t-20 -89.16 -29.06 19.6 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.135 -1.061 . . . . 75.219999999999999 108.135 173.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.4 139.32 30.67 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.789 -1.096 . . . . 51.149999999999999 109.445 175.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.632 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -84.0 111.17 19.03 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.818 -0.353 . . . . 71.409999999999997 110.486 -177.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.47 HG22 HG23 ' A' ' 95' ' ' ILE . 43.6 t -111.89 104.76 17.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.176 -0.466 . . . . 72.209999999999994 109.811 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.422 ' HB2' ' HG3' ' A' ' 94' ' ' GLN . 15.2 m -94.38 120.29 34.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.879 -0.601 . . . . 71.299999999999997 110.74 -178.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -94.0 91.89 7.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.375 . . . . 64.099999999999994 110.284 -178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -116.08 127.35 73.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.516 0.674 . . . . 72.310000000000002 111.602 -177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HB3' HG21 ' A' ' 59' ' ' ILE . 37.5 t80 -131.69 119.28 21.15 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.345 -0.843 . . . . 74.400000000000006 109.114 171.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 60.28 35.23 20.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.266 0.555 . . . . 51.240000000000002 109.781 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 72.43 1.44 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.123 -0.944 . . . . 64.420000000000002 111.517 -177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.95 127.09 40.74 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 110.106 -0.331 . . . . 70.319999999999993 110.106 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.91 112.11 5.37 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.501 -1.296 . . . . 74.230000000000004 107.501 168.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.453 HG21 ' HB3' ' A' ' 54' ' ' PHE . 2.4 pp -106.77 178.46 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 113.543 0.942 . . . . 74.420000000000002 113.543 -163.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 44.9 p90 -142.32 162.72 34.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.414 -1.266 . . . . 73.400000000000006 109.75 -169.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.487 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 33.5 tt0 -71.96 101.19 2.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.256 0.551 . . . . 74.510000000000005 110.098 177.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -111.74 -155.84 13.29 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.716 -0.675 . . . . 33.210000000000001 111.966 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -68.06 -21.04 43.53 Favored 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 122.775 2.317 . . . . 65.129999999999995 112.649 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 82' ' ' LYS . 30.5 tttm -100.67 -18.41 16.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.951 -178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.469 ' HA ' ' HG2' ' A' ' 80' ' ' MET . 42.2 m-85 -114.76 153.65 29.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.958 0.409 . . . . 73.030000000000001 111.254 -169.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 78' ' ' MET . 48.4 tptt -152.49 118.98 5.62 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.059 -0.719 . . . . 72.200000000000003 109.059 173.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.2 mtm -128.38 134.99 48.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.946 0.403 . . . . 72.510000000000005 111.08 -174.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -88.03 165.62 15.04 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.876 -0.786 . . . . 73.150000000000006 108.876 172.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.1 tp -113.03 139.7 36.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.108 0.48 . . . . 71.430000000000007 111.229 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -70.95 87.25 0.72 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.674 -0.694 . . . . 72.420000000000002 111.199 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -143.65 -50.86 0.32 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.861 -0.609 . . . . 52.140000000000001 110.672 176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -82.47 -46.79 13.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.052 -0.522 . . . . 65.439999999999998 111.352 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.0 p -108.42 -25.38 11.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.631 -173.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 79.91 14.53 80.67 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.317 -1.113 . . . . 72.549999999999997 110.317 -170.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' MET . 54.7 mt -115.56 139.85 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-N 114.882 -0.659 . . . . 62.219999999999999 109.84 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 75.5 mt -117.05 111.34 34.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 CA-C-N 115.866 -0.607 . . . . 72.140000000000001 109.391 174.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.466 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 1.4 mp0 -108.28 134.27 51.34 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.044 0.45 . . . . 62.439999999999998 109.935 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.763 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 52.3 ttp -119.29 115.87 25.05 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.219 -0.901 . . . . 65.209999999999994 109.82 179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -110.97 116.27 30.91 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.815 -0.63 . . . . 71.519999999999996 109.908 -175.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' HA ' ' A' ' 65' ' ' TYR . 42.5 mtm -139.21 161.68 36.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.061 0.457 . . . . 70.239999999999995 111.539 -173.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 1.0 OUTLIER -128.39 -99.44 0.36 Allowed 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.721 -0.844 . . . . 72.510000000000005 108.721 158.156 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.533 ' HD3' ' N ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -159.12 146.69 17.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 118.131 0.423 . . . . 65.219999999999999 110.526 176.227 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.558 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 26.3 tp -96.99 -77.15 0.5 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.781 -0.822 . . . . 74.409999999999997 108.781 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.558 ' OE1' ' HG ' ' A' ' 83' ' ' LEU . 2.4 mp0 -102.66 178.93 4.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.072 -1.084 . . . . 62.299999999999997 108.072 165.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -76.12 -26.9 56.83 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.519 -0.548 . . . . 74.239999999999995 109.519 175.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.72 -7.21 54.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.482 -0.781 . . . . 63.340000000000003 111.509 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.45 ' HB3' ' HD2' ' A' ' 64' ' ' LYS . 4.8 m-20 -84.01 -10.29 58.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 64.209999999999994 110.813 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' LEU . 2.7 tp10 -95.47 139.56 31.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.033 -0.531 . . . . 75.420000000000002 109.775 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -169.73 -150.92 7.07 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.67 -0.776 . . . . 73.420000000000002 112.624 -176.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 11.6 m -94.93 115.75 27.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.899 0.381 . . . . 55.409999999999997 111.272 -178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -92.88 139.26 30.72 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.232 -0.655 . . . . 71.409999999999997 109.232 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 32.5 m -143.49 106.5 4.51 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.273 0.558 . . . . 63.32 110.665 179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.61 131.44 55.62 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.698 -0.683 . . . . 74.120000000000005 110.223 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.422 ' HG3' ' HB2' ' A' ' 51' ' ' SER . 1.7 pt20 -123.01 122.56 38.82 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.115 -0.493 . . . . 50.100000000000001 109.766 177.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.47 HG23 HG22 ' A' ' 50' ' ' VAL . 22.7 mt -111.54 109.8 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.654 -0.703 . . . . 72.310000000000002 110.537 -178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.632 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 36.6 tt0 -93.86 99.24 11.64 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.94 -0.763 . . . . 72.519999999999996 108.94 175.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -119.3 104.13 10.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.159 -0.473 . . . . 72.450000000000003 110.404 -174.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 77.43 -72.09 2.2 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.743 -0.662 . . . . 65.239999999999995 112.537 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -138.71 -45.43 0.49 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.892 0.377 . . . . 60.049999999999997 111.1 -174.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.04 154.78 21.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 63.039999999999999 111.548 -176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -113.31 112.71 24.15 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.741 -0.663 . . . . 74.430000000000007 110.226 175.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.449 ' CA ' HG11 ' A' ' 19' ' ' VAL . . . -88.59 89.55 1.6 Allowed Glycine 0 N--CA 1.441 -1.001 0 N-CA-C 111.361 -0.695 . . . . 72.209999999999994 111.361 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -102.23 132.91 47.87 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.884 -0.413 . . . . 75.450000000000003 109.884 179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.7 t -135.92 123.77 22.62 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 116.317 -0.401 . . . . 75.200000000000003 110.074 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 62.2 m -98.42 118.24 34.64 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.963 -0.562 . . . . 74.140000000000001 109.606 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -126.32 105.72 9.0 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.158 -0.682 . . . . 74.540000000000006 109.158 -177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.473 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -103.39 121.89 55.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.068 0.461 . . . . 70.129999999999995 111.315 -175.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.41 ' O ' ' HG3' ' A' ' 88' ' ' GLU . 91.0 mt -121.32 104.08 9.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.01 -0.541 . . . . 65.329999999999998 109.577 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 41.6 mt -147.37 131.82 10.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 110.161 -0.311 . . . . 73.540000000000006 110.161 179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.44 -112.22 0.83 Allowed Glycine 0 CA--C 1.521 0.454 0 O-C-N 123.901 0.751 . . . . 51.43 114.447 171.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.639 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 1.9 p30 -76.55 -23.18 53.6 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.647 0.261 . . . . 30.129999999999999 111.227 -176.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.1 t -62.19 -55.83 21.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.593 0.235 . . . . 65.129999999999995 111.01 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -65.55 -24.05 67.01 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.468 -0.493 . . . . 73.0 111.723 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.639 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -79.59 -24.96 41.66 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.611 -0.436 . . . . 64.099999999999994 109.988 -178.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -76.22 -48.16 21.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.364 -0.38 . . . . 61.520000000000003 110.008 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.2 mp -57.83 -31.95 67.14 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.187 0.518 . . . . 62.020000000000003 109.98 175.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 31' ' ' GLU . 2.5 tp-100 -54.85 -42.94 72.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.248 -0.887 . . . . 73.409999999999997 110.348 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.873 ' HA ' ' HE3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -79.16 -28.1 42.74 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.15 -0.477 . . . . 72.239999999999995 111.441 -179.613 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -67.33 -25.61 66.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.985 0.422 . . . . 74.439999999999998 110.666 178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -91.43 -56.54 3.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.11 -0.496 . . . . 75.150000000000006 111.536 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.477 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 50.9 mt-10 -133.25 173.08 11.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.002 0.429 . . . . 41.520000000000003 110.784 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 118' ' ' LYS . 34.4 p90 . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.591 -0.719 . . . . 61.100000000000001 109.784 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 109.917 -0.401 . . . . 71.129999999999995 109.917 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -106.07 121.0 43.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.374 -0.375 . . . . 74.310000000000002 111.615 -177.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.586 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 41.0 mt-10 -107.33 108.47 19.86 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.078 -0.712 . . . . 45.329999999999998 109.078 168.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ttt -76.44 -36.56 57.87 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.081 0.467 . . . . 62.520000000000003 110.077 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 ptmt -60.08 -28.95 68.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.531 -0.758 . . . . 74.510000000000005 112.421 -177.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.586 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 21.4 ptt180 -74.52 -25.72 59.52 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 120.793 -0.363 . . . . 73.0 110.817 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.8 tt -64.27 -34.99 79.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.952 0.406 . . . . 74.439999999999998 110.403 -176.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -77.04 -14.31 59.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.095 -0.502 . . . . 75.010000000000005 110.774 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.12 -40.42 19.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.186 -0.461 . . . . 54.109999999999999 110.627 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.47 HD22 ' HG2' ' A' ' 77' ' ' GLU . 4.0 mm? -63.73 137.06 57.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.232 -0.44 . . . . 64.129999999999995 110.624 177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.1 m -152.83 164.93 36.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.547 -0.297 . . . . 61.119999999999997 110.549 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -82.57 157.54 23.45 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.877 -0.601 . . . . 75.239999999999995 110.126 -178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -48.51 136.2 13.25 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.205 0.817 . . . . 75.239999999999995 113.205 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -153.06 101.13 2.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.084 -0.962 . . . . 73.519999999999996 109.3 176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -90.49 113.23 25.15 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.302 -0.408 . . . . 64.439999999999998 110.757 -176.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.517 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 79.5 t80 -81.11 -53.76 0.76 Allowed Pre-proline 0 CA--C 1.54 0.566 0 CA-C-N 116.561 -0.291 . . . . 74.239999999999995 111.316 179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.517 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 78.7 Cg_endo -77.32 160.54 32.44 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 121.649 1.566 . . . . 75.439999999999998 111.921 178.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.9 m -92.29 101.99 14.48 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.108 0.48 . . . . 64.430000000000007 110.116 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG22 ' H ' ' A' ' 21' ' ' THR . 7.5 p -150.48 136.32 10.55 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.723 -0.671 . . . . 61.229999999999997 109.679 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -56.59 -29.65 79.96 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.944 2.429 . . . . 71.329999999999998 112.753 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.552 ' H ' HG22 ' A' ' 19' ' ' VAL . 14.4 m -72.48 152.62 41.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.845 -0.616 . . . . 70.430000000000007 110.734 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.984 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 11.3 mmmm -107.32 22.41 16.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.135 0.493 . . . . 54.43 110.24 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.632 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 8.3 t -121.53 118.68 29.89 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.529 -0.76 . . . . 70.209999999999994 109.727 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.426 ' HG2' ' HG3' ' A' ' 17' ' ' PRO . 9.4 tp10 -170.98 160.69 6.65 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 109.409 -0.589 . . . . 74.109999999999999 109.409 -178.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.81 137.87 33.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.217 -0.447 . . . . 74.140000000000001 110.382 -177.839 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.47 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -131.45 100.94 5.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.056 0.455 . . . . 71.430000000000007 110.56 177.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.95 136.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.852 0.358 . . . . 73.0 110.981 -177.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.6 133.89 55.47 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 72.129999999999995 110.083 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 116' ' ' LEU . 42.9 mt -115.19 133.67 60.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.342 -0.39 . . . . 71.349999999999994 110.974 -175.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 80.6 mt -121.2 137.91 54.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.612 -0.514 . . . . 63.030000000000001 109.612 174.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.592 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 1.6 pp20? -75.11 -9.95 59.02 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.012 0.434 . . . . 55.229999999999997 111.194 -176.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.592 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 16.7 mtmm -75.81 16.24 0.43 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.781 -0.645 . . . . 60.299999999999997 111.319 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 71.74 44.45 48.21 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.087 -0.577 . . . . 72.510000000000005 111.859 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HA ' ' HA ' ' A' ' 81' ' ' GLU . 28.9 tp60 -143.83 116.23 8.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.839 0.352 . . . . 44.240000000000002 110.141 -176.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -102.07 128.4 54.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 109.867 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -111.33 110.5 21.01 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.299 -0.63 . . . . 64.409999999999997 109.299 178.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 25' ' ' LEU . 26.7 t80 -111.89 128.42 56.13 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.474 -0.785 . . . . 75.409999999999997 110.613 -171.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 25.7 p-90 -150.97 172.0 16.4 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.828 -0.434 . . . . 72.200000000000003 109.828 173.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.566 ' HB3' HD22 ' A' ' 25' ' ' LEU . 23.1 ptm -150.12 160.44 43.65 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.83 0.348 . . . . 71.25 110.656 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 23' ' ' SER . 11.3 pt20 -121.22 141.73 50.59 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.666 -0.697 . . . . 62.509999999999998 110.141 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -133.07 154.04 50.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.793 -0.447 . . . . 74.040000000000006 109.793 176.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.984 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.1 pt-20 -99.85 -33.77 10.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.873 0.368 . . . . 72.129999999999995 110.939 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.551 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 57.3 mttp -99.1 134.48 41.88 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.285 -0.416 . . . . 63.119999999999997 110.411 -179.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.493 HD11 ' CA ' ' A' ' 74' ' ' GLY . 4.0 mm? -107.55 -0.27 22.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.492 0.663 . . . . 64.25 109.921 178.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.446 ' C ' ' H ' ' A' ' 47' ' ' ASN . 4.6 p -83.34 162.78 20.97 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.889 -1.051 . . . . 72.319999999999993 108.951 171.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.6 t -70.71 30.68 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.114 0.413 . . . . 74.310000000000002 112.114 -174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.446 ' H ' ' C ' ' A' ' 45' ' ' SER . 14.7 m120 -85.82 -20.83 28.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.182 0.515 . . . . 74.019999999999996 109.873 176.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.492 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -100.75 112.32 24.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.653 -0.703 . . . . 73.120000000000005 111.001 -178.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -100.95 112.58 25.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 110.189 176.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.474 HG22 HG23 ' A' ' 95' ' ' ILE . 52.0 t -100.84 114.18 39.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.95 -0.568 . . . . 75.219999999999999 110.109 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.8 m -89.18 107.09 18.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.811 0.338 . . . . 74.109999999999999 110.784 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -78.84 81.61 5.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.285 -0.635 . . . . 72.540000000000006 109.285 175.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.685 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.8 mm -107.45 120.59 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.564 0.697 . . . . 70.549999999999997 111.963 -172.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -119.96 108.75 14.7 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.187 -0.915 . . . . 64.120000000000005 109.038 173.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 24.9 t-20 56.24 45.56 22.9 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.389 0.614 . . . . 73.219999999999999 109.993 -177.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.403 ' HB2' ' HE3' ' A' ' 57' ' ' LYS . 41.1 mt-10 71.31 3.92 4.85 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.462 -0.79 . . . . 74.310000000000002 112.194 177.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 7.2 mmtp -111.64 143.63 42.2 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.203 -0.295 . . . . 74.010000000000005 110.203 -176.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -83.3 133.35 34.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.94 0.4 . . . . 75.099999999999994 109.961 177.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 12.1 pt -111.49 164.76 7.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 112.656 0.613 . . . . 54.409999999999997 112.656 -172.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -126.84 161.72 27.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.919 -1.037 . . . . 65.420000000000002 109.181 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 31.6 tt0 -65.09 145.2 56.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.984 -0.376 . . . . 74.230000000000004 109.984 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -156.6 -140.43 2.96 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.717 -0.754 . . . . 63.219999999999999 112.358 -176.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 23.1 Cg_endo -62.85 -64.39 0.07 OUTLIER 'Trans proline' 0 CA--C 1.529 0.245 0 C-N-CA 122.758 2.305 . . . . 60.0 112.698 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 80' ' ' MET . 47.5 pttt -86.58 -22.24 26.38 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.881 -0.415 . . . . 61.439999999999998 109.881 179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.485 ' CE2' ' HE2' ' A' ' 64' ' ' LYS . 71.9 m-85 -81.08 130.71 35.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.946 -0.57 . . . . 75.400000000000006 111.055 -174.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 78' ' ' MET . 56.6 mmtt -137.65 122.76 19.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.14 -0.936 . . . . 74.239999999999995 108.545 173.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 23.4 ptp -152.2 110.98 3.8 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.174 0.511 . . . . 73.129999999999995 110.9 -175.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 -107.46 115.08 29.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.169 0.509 . . . . 64.400000000000006 110.529 178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.1 tp -82.02 93.79 2.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.569 0.7 . . . . 64.120000000000005 109.444 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -96.03 117.95 31.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.685 -0.688 . . . . 62.229999999999997 110.904 -177.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -96.66 11.89 33.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.613 -0.721 . . . . 73.140000000000001 111.053 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -97.76 -43.09 7.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.383 -0.371 . . . . 53.539999999999999 110.908 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 53.2 p -108.34 -43.58 4.31 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.135 -0.484 . . . . 71.420000000000002 111.364 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.493 ' CA ' HD11 ' A' ' 44' ' ' LEU . . . 105.24 8.46 35.82 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.614 -0.803 . . . . 75.329999999999998 112.335 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 45.1 mm -105.81 106.85 21.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 109.754 -0.462 . . . . 70.140000000000001 109.754 177.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 62.4 mt -97.34 138.68 21.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.252 -0.647 . . . . 64.150000000000006 109.252 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.47 ' HG2' HD22 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -125.53 170.3 11.58 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.392 0.615 . . . . 71.239999999999995 112.355 -175.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.702 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 46.7 ttm -159.85 118.63 2.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.961 -1.018 . . . . 63.310000000000002 109.703 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -110.68 111.98 23.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.838 0.351 . . . . 72.109999999999999 110.712 -176.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 65.8 mtm -141.68 131.19 23.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.896 -0.593 . . . . 74.340000000000003 109.487 179.235 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 7.3 pt-20 -87.53 -59.65 2.19 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.321 -0.552 . . . . 70.200000000000003 110.008 175.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.516 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.6 OUTLIER 166.82 162.06 0.03 OUTLIER 'General case' 0 C--O 1.233 0.218 0 C-N-CA 124.7 1.2 . . . . 73.549999999999997 108.385 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 28.0 tp -137.42 -72.44 0.43 Allowed 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.026 -0.361 . . . . 64.150000000000006 110.026 175.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -162.14 153.92 18.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.357 -0.608 . . . . 71.519999999999996 109.357 178.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -54.53 -25.21 24.46 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.941 0.719 . . . . 72.430000000000007 112.941 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -76.21 -27.58 56.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.931 0.396 . . . . 71.430000000000007 111.205 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -99.46 -28.01 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.491 0.662 . . . . 72.120000000000005 109.654 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -72.68 162.16 29.84 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.888 -1.051 . . . . 73.400000000000006 109.123 171.511 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.465 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . 177.62 -157.43 21.93 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 119.811 -1.185 . . . . 63.240000000000002 112.605 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.55 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.3 m -86.13 103.01 14.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 71.129999999999995 111.001 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 83.4 m-85 -83.8 118.9 24.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.889 -0.782 . . . . 71.400000000000006 108.889 175.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.685 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 20.4 m -128.48 104.9 7.95 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.805 0.336 . . . . 54.109999999999999 110.697 -174.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -106.65 114.83 29.17 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.163 0.506 . . . . 65.319999999999993 111.146 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -106.29 119.02 38.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.224 -0.898 . . . . 73.239999999999995 109.357 176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.474 HG23 HG22 ' A' ' 50' ' ' VAL . 4.8 mp -120.49 112.19 35.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.6 -0.273 . . . . 54.520000000000003 110.688 -176.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 64.4 tt0 -101.74 116.11 32.0 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.584 -0.524 . . . . 75.439999999999998 109.584 174.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -108.59 87.34 2.47 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.258 0.552 . . . . 74.0 109.54 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.71 -66.5 2.4 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.565 -0.743 . . . . 55.350000000000001 112.409 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -127.6 -66.15 0.89 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.02 0.438 . . . . 73.209999999999994 110.579 -178.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.25 140.9 58.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.518 -0.765 . . . . 70.310000000000002 110.983 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 15.5 m -120.52 114.43 21.75 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.789 -0.641 . . . . 33.109999999999999 110.683 179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.89 164.65 21.76 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 110.59 -1.004 . . . . 64.0 110.59 176.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -161.56 144.88 12.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 117.21 0.505 . . . . 71.510000000000005 111.184 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.6 t -134.04 121.74 21.99 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.233 -0.654 . . . . 40.439999999999998 109.233 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 26.7 m -107.11 118.09 35.78 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 109.98 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -128.88 108.27 10.3 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.513 -0.551 . . . . 72.430000000000007 109.513 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.55 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.9 p -96.04 113.56 30.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.335 0.588 . . . . 74.409999999999997 111.089 -178.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.636 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 71.4 mt -111.73 102.91 11.17 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.978 -0.555 . . . . 54.530000000000001 109.73 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.465 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.6 mt -147.14 126.44 4.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 110.389 -0.226 . . . . 74.030000000000001 110.389 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 42.35 -119.7 2.09 Favored Glycine 0 CA--C 1.521 0.415 0 O-C-N 123.838 0.711 . . . . 51.450000000000003 114.567 173.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.511 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 24.0 t70 -75.2 -21.36 58.74 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.241 0.543 . . . . 72.120000000000005 110.806 -177.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 47.5 t -64.56 -43.73 96.8 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-N 116.398 -0.364 . . . . 75.239999999999995 111.158 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.636 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 5.8 p90 -72.96 -28.7 62.56 Favored 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 120.343 -0.543 . . . . 74.319999999999993 112.369 -173.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -68.28 -14.39 62.96 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.605 -0.438 . . . . 73.140000000000001 111.363 -175.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -67.29 -42.52 83.62 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.882 0.372 . . . . 71.510000000000005 110.045 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.704 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -62.69 -42.1 99.46 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.884 -0.598 . . . . 74.0 110.406 -178.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 2.2 mp0 -59.99 -40.85 90.57 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.828 -0.624 . . . . 74.040000000000006 110.753 177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 114' ' ' LYS . 54.2 mtpt -65.66 -33.2 75.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 75.209999999999994 111.52 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -90.13 -11.06 42.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.777 0.322 . . . . 75.109999999999999 111.203 -178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -84.35 -55.36 4.21 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.023 0.439 . . . . 75.530000000000001 110.802 179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.492 ' HB2' ' CG ' ' A' ' 31' ' ' GLU . 47.1 mt-10 -133.4 -165.17 1.58 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.095 -0.502 . . . . 63.030000000000001 110.894 -177.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 C--O 1.248 0.982 0 CA-C-N 115.253 -0.885 . . . . 75.310000000000002 110.98 174.087 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 121.013 0.435 . . . . 74.409999999999997 110.034 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -99.4 90.98 4.72 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.439 0.638 . . . . 75.420000000000002 109.697 178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -89.0 176.0 7.18 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.206 -0.906 . . . . 60.539999999999999 110.999 -173.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.449 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 1.8 pmm? -70.34 -12.09 61.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.476 . . . . 74.319999999999993 110.721 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -55.68 -29.32 59.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.731 -0.668 . . . . 70.230000000000004 112.283 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -48.08 41.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.313 0.578 . . . . 74.310000000000002 110.451 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.507 HD22 ' H ' ' A' ' 7' ' ' LEU . 2.7 mm? -66.19 -26.08 67.23 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.443 -0.798 . . . . 73.120000000000005 111.516 -172.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 4' ' ' MET . 85.9 mt -64.5 -32.52 74.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.092 -0.504 . . . . 74.120000000000005 110.89 179.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.569 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -92.1 -58.98 2.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.346 -0.388 . . . . 51.229999999999997 111.058 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HG ' HG21 ' A' ' 75' ' ' ILE . 1.8 tt -66.66 98.91 0.55 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-N 115.806 -0.634 . . . . 62.039999999999999 110.647 -177.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 44.8 t -150.49 121.36 7.61 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.181 -0.463 . . . . 44.409999999999997 111.339 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.4 mm-40 64.96 93.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.587 -0.733 . . . . 74.420000000000002 112.736 173.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.4 mp0 -65.3 125.95 26.66 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.37 -0.604 . . . . 71.299999999999997 109.37 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -161.98 105.15 1.18 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.766 -0.197 . . . . 74.140000000000001 111.267 -173.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.88 145.36 24.62 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.385 -0.969 . . . . 73.239999999999995 108.385 164.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.584 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 68.0 t80 -96.69 -54.23 0.21 Allowed Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 112.778 0.659 . . . . 74.239999999999995 112.778 -175.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 67.4 Cg_endo -88.81 -171.0 0.53 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.759 1.639 . . . . 74.530000000000001 113.099 -176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 23.8 p -89.67 121.52 31.92 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.915 -0.584 . . . . 63.219999999999999 110.198 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.412 HG22 HG22 ' A' ' 21' ' ' THR . 7.2 p -144.81 131.07 9.8 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.505 -0.316 . . . . 71.129999999999995 110.684 -177.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.434 ' O ' ' HB ' ' A' ' 21' ' ' THR . 7.8 Cg_exo -74.55 51.61 2.66 Favored 'Trans proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.353 2.702 . . . . 70.430000000000007 113.025 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.491 HG23 ' H ' ' A' ' 23' ' ' SER . 14.9 t 177.89 -172.52 0.12 Allowed 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.711 -0.477 . . . . 72.239999999999995 109.711 175.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -109.36 2.73 20.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.585 0.231 . . . . 54.409999999999997 111.004 -175.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.571 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 9.1 t -98.27 102.87 14.74 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.242 0.544 . . . . 75.239999999999995 110.945 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -115.07 139.85 49.54 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.389 -0.823 . . . . 71.25 109.403 172.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.523 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -85.3 107.08 17.15 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 107.929 -1.137 . . . . 72.129999999999995 107.929 173.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.54 147.51 35.24 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.249 0.547 . . . . 72.319999999999993 110.925 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.1 p -139.7 131.38 33.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.644 -0.707 . . . . 35.020000000000003 110.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 7.0 tp10 -110.46 127.05 54.95 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.209 -0.663 . . . . 61.119999999999997 109.209 176.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.48 HG21 ' HA ' ' A' ' 117' ' ' GLN . 3.2 mp -114.46 134.37 57.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 120.964 0.411 . . . . 75.400000000000006 111.186 -171.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.593 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 92.3 mt -117.42 139.1 51.32 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.875 -0.602 . . . . 72.109999999999999 109.507 174.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.806 ' HG2' ' HB2' ' A' ' 122' ' ' PHE . 0.7 OUTLIER -71.0 7.63 1.14 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.667 0.618 . . . . 54.140000000000001 112.667 -174.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 45.8 mttm -95.84 -0.75 50.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.907 0.384 . . . . 74.109999999999999 110.792 -177.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' ' OE1' ' A' ' 117' ' ' GLN . . . 85.61 58.18 2.08 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 110.033 -1.227 . . . . 73.239999999999995 110.033 -171.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.593 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 26.3 tp60 -148.52 119.91 7.89 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.668 -0.493 . . . . 72.540000000000006 109.668 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -117.23 120.78 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.256 0.551 . . . . 75.049999999999997 111.098 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.569 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 36.6 ttp180 -99.27 111.21 23.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.877 -0.601 . . . . 74.219999999999999 109.71 176.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.531 ' HB3' ' HB3' ' A' ' 78' ' ' MET . 45.5 t80 -100.38 124.48 45.92 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.702 -0.681 . . . . 73.010000000000005 110.58 -177.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 39.0 p-90 -150.47 123.72 8.9 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.659 -0.7 . . . . 73.329999999999998 109.636 176.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.566 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 24.9 ptm -114.01 147.59 38.39 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.529 -0.468 . . . . 72.219999999999999 110.169 177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.571 ' O ' ' HA ' ' A' ' 23' ' ' SER . 41.7 mt-30 -97.74 159.79 14.71 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.648 -0.706 . . . . 73.510000000000005 110.574 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -169.21 167.66 10.21 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.621 0.576 . . . . 73.040000000000006 109.886 177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -119.7 -7.26 10.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.159 0.504 . . . . 63.140000000000001 109.88 173.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 43' ' ' LYS . 13.6 tppt? -124.99 139.36 53.89 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.884 -0.598 . . . . 70.200000000000003 109.533 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.806 ' HG ' ' H ' ' A' ' 45' ' ' SER . 0.5 OUTLIER -109.48 -73.23 0.69 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 111.64 0.237 . . . . 62.119999999999997 111.64 -176.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.806 ' H ' ' HG ' ' A' ' 44' ' ' LEU . 14.8 t -107.0 109.41 21.3 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.003 0.43 . . . . 43.340000000000003 110.276 -177.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.5 m -162.67 -84.27 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.702 -0.851 . . . . 63.310000000000002 108.702 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.47 8.57 3.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.812 -0.631 . . . . 75.439999999999998 109.575 173.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.78 90.93 5.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.49 -0.777 . . . . 71.310000000000002 110.051 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -108.9 132.89 53.61 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.455 -0.793 . . . . 52.350000000000001 110.615 -178.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.8 p -104.47 114.42 44.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.411 0.624 . . . . 70.439999999999998 110.612 179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.0 t -95.86 135.51 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.762 -0.654 . . . . 73.010000000000005 109.458 178.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -101.02 96.24 7.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.358 -0.383 . . . . 72.25 110.797 -176.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.529 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 4.7 mp -100.51 122.54 52.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.133 -0.485 . . . . 51.310000000000002 110.267 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HB3' HG23 ' A' ' 59' ' ' ILE . 40.0 t80 -126.37 107.29 10.15 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 109.477 -0.564 . . . . 64.140000000000001 109.477 174.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.42 34.32 24.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.284 0.564 . . . . 72.099999999999994 110.001 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 69.55 17.89 7.85 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.259 -0.882 . . . . 71.530000000000001 111.228 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -108.24 151.18 26.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.431 -0.804 . . . . 73.409999999999997 109.23 172.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -86.55 131.84 34.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.45 -0.574 . . . . 55.240000000000002 109.45 172.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.4 pt -110.16 157.64 10.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.392 0.615 . . . . 71.319999999999993 112.16 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -129.86 161.59 30.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.924 -1.034 . . . . 74.540000000000006 109.374 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -69.17 145.0 53.64 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.993 -0.373 . . . . 71.549999999999997 109.993 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -178.79 -126.48 1.01 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.336 -0.935 . . . . 65.549999999999997 112.528 -176.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.43 -75.6 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.431 2.754 . . . . 73.129999999999995 113.686 -175.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.511 ' HB3' ' HG ' ' A' ' 83' ' ' LEU . 33.1 pttt -95.82 -3.9 44.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.104 0.478 . . . . 73.400000000000006 109.998 -178.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.525 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 10.4 m-85 -92.82 128.95 38.87 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.826 -0.625 . . . . 75.209999999999994 110.042 -175.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.5 tptp -152.86 117.41 4.99 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.459 -0.571 . . . . 70.030000000000001 109.459 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.4 mpp? -112.99 158.74 19.89 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.906 0.384 . . . . 70.329999999999998 110.415 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -159.77 124.96 4.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.681 . . . . 71.049999999999997 109.867 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.916 HD13 HG12 ' A' ' 76' ' ' ILE . 1.3 tp -107.3 115.79 49.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 115.272 -0.876 . . . . 65.340000000000003 110.383 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -82.5 100.18 9.93 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.696 -0.684 . . . . 55.240000000000002 109.757 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.41 21.88 8.57 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.143 0.497 . . . . 71.230000000000004 110.4 176.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -93.17 -42.07 9.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.705 -0.679 . . . . 64.230000000000004 109.358 173.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.6 m -109.46 -43.31 4.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.705 -0.68 . . . . 75.420000000000002 110.239 178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 121.46 49.01 0.27 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.776 -0.726 . . . . 54.32 112.312 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.441 HG21 ' HG ' ' A' ' 10' ' ' LEU . 47.9 mm -124.11 125.28 70.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 120.716 0.293 . . . . 75.530000000000001 110.439 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.916 HG12 HD13 ' A' ' 69' ' ' ILE . 46.5 mt -97.57 113.86 33.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.51 -0.552 . . . . 61.329999999999998 109.51 176.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -113.95 143.82 44.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.047 0.451 . . . . 54.009999999999998 111.033 -174.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 62.3 ttp -136.86 147.07 46.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.127 -0.488 . . . . 74.219999999999999 109.844 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -130.15 121.72 26.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.813 0.339 . . . . 62.140000000000001 110.511 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.525 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 65.7 mtt -144.25 161.62 38.46 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.023 -0.732 . . . . 72.430000000000007 109.023 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 9.0 pt-20 -134.1 -61.52 0.78 Allowed 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.234 -0.587 . . . . 53.299999999999997 111.482 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.443 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 179.16 161.53 0.76 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.345 -0.243 . . . . 73.540000000000006 110.345 -174.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.511 ' HG ' ' HB3' ' A' ' 64' ' ' LYS . 22.6 mt -149.86 -72.41 0.18 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.399 0.619 . . . . 75.430000000000007 109.755 171.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -145.9 154.5 42.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.273 -0.876 . . . . 73.219999999999999 108.802 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -58.96 -29.14 66.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.899 0.38 . . . . 71.25 111.025 -178.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -76.62 -27.68 55.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.308 -0.405 . . . . 71.430000000000007 111.279 178.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -88.83 -27.47 21.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.351 0.596 . . . . 63.020000000000003 109.736 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.606 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.8 OUTLIER -74.2 113.08 10.98 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.632 -0.877 . . . . 72.430000000000007 108.632 168.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -141.54 -152.72 5.78 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.395 -0.907 . . . . 41.310000000000002 113.167 -174.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.8 m -93.97 108.3 20.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.351 -0.425 . . . . 64.439999999999998 110.667 -178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.4 m-85 -89.69 136.28 33.13 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.334 -0.617 . . . . 74.510000000000005 109.334 178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.529 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 25.7 m -132.29 123.55 27.11 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.076 0.465 . . . . 73.099999999999994 110.763 -178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.406 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 84.3 m-85 -123.06 134.79 54.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.596 -0.729 . . . . 75.0 109.569 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -144.13 116.34 8.45 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.989 0.423 . . . . 55.299999999999997 110.763 178.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.7 mp -132.44 121.13 44.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.692 -0.685 . . . . 74.420000000000002 109.79 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.468 ' HA ' ' HA ' ' A' ' 101' ' ' THR . 63.1 tt0 -82.47 112.55 19.51 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.444 -0.576 . . . . 73.049999999999997 109.444 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.04 112.58 19.74 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.954 0.406 . . . . 74.319999999999993 111.181 -176.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.19 -83.6 0.85 Allowed Glycine 0 N--CA 1.446 -0.69 0 CA-C-N 115.754 -0.657 . . . . 54.409999999999997 112.21 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -134.58 -35.37 0.89 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.818 0.342 . . . . 73.219999999999999 110.926 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.78 147.9 25.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.222 -0.445 . . . . 61.020000000000003 111.35 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.468 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 17.3 p -98.28 114.1 26.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.006 0.432 . . . . 71.109999999999999 110.41 175.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.08 82.75 1.66 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.928 -0.653 . . . . 31.239999999999998 111.578 179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.406 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 2.1 p80 -103.81 132.88 49.65 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.611 -0.515 . . . . 70.129999999999995 109.611 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 32.0 t -136.2 139.96 43.19 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 116.233 -0.439 . . . . 71.310000000000002 110.253 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.7 m -117.19 117.87 30.77 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 109.299 -0.63 . . . . 73.019999999999996 109.299 175.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.441 ' HA ' HD22 ' A' ' 106' ' ' LEU . 0.5 OUTLIER -123.68 103.13 8.22 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.513 -0.551 . . . . 74.140000000000001 109.513 -175.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 5.7 p -100.35 123.28 53.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 121.155 0.502 . . . . 71.310000000000002 110.799 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 97.4 mt -125.64 104.02 8.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.036 -0.529 . . . . 65.439999999999998 110.043 177.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 88' ' ' GLU . 47.6 mt -146.71 125.16 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 110.273 -0.269 . . . . 72.450000000000003 110.273 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 40.89 -114.28 0.54 Allowed Glycine 0 C--N 1.333 0.413 0 O-C-N 123.754 0.659 . . . . 72.519999999999996 114.14 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.634 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.8 t70 -62.9 -29.06 70.49 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.101 0.476 . . . . 70.209999999999994 111.414 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.0 t -69.44 -42.23 80.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.296 -0.411 . . . . 65.5 111.036 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.486 ' HB2' HD22 ' A' ' 108' ' ' LEU . 2.2 p90 -73.25 -25.68 60.81 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 119.853 -0.739 . . . . 72.319999999999993 111.544 -174.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.634 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.61 -20.91 61.2 Favored 'General case' 0 C--O 1.232 0.133 0 C-N-CA 120.385 -0.526 . . . . 63.200000000000003 110.027 179.064 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 119' ' ' GLU . 23.5 ttmm -64.06 -46.63 83.5 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.426 0.631 . . . . 70.5 109.488 173.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -70.3 -31.55 68.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.703 -0.68 . . . . 70.439999999999998 110.537 176.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.48 ' HA ' HG21 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -77.09 -58.07 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.248 0.462 . . . . 73.0 112.248 -174.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -89.55 -38.02 14.29 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.621 0.6 . . . . 75.310000000000002 112.621 -170.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.557 ' HB2' ' O ' ' A' ' 115' ' ' LYS . 52.5 mt-10 -69.67 -10.73 59.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 63.240000000000002 110.727 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.56 -47.76 5.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.849 -0.614 . . . . 60.25 110.225 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -140.27 115.87 10.13 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.483 -0.326 . . . . 73.109999999999999 111.731 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.806 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 92.3 m-85 . . . . . 0 C--O 1.251 1.153 0 CA-C-N 115.484 -0.78 . . . . 63.32 112.543 172.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 109.862 -0.421 . . . . 70.219999999999999 109.862 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -105.87 106.73 17.37 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.13 -0.322 . . . . 62.439999999999998 110.13 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -119.11 100.69 7.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.015 0.436 . . . . 72.400000000000006 112.167 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 52.8 ttp -72.44 -19.3 61.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.622 -0.881 . . . . 73.409999999999997 108.622 171.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -60.11 -29.12 68.4 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 114.896 -1.047 . . . . 71.25 111.008 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -75.25 -49.61 18.75 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.639 -0.424 . . . . 70.010000000000005 110.097 175.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.679 ' HA ' ' HB3' ' A' ' 10' ' ' LEU . 10.6 mp -56.02 -25.69 45.56 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.655 -0.702 . . . . 73.409999999999997 112.361 -175.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 93.0 mt -54.47 -46.37 73.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.783 0.325 . . . . 72.239999999999995 110.571 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.29 -39.23 11.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.192 -0.458 . . . . 63.340000000000003 111.142 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 7' ' ' LEU . 67.9 tp -53.37 116.52 2.48 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.709 -0.678 . . . . 63.43 111.978 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.427 ' OG ' ' HD2' ' A' ' 36' ' ' ARG . 6.9 m -132.7 152.74 51.64 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.597 -0.729 . . . . 75.040000000000006 109.528 179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -76.92 166.78 22.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.844 0.354 . . . . 62.140000000000001 111.097 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 13.2 pt-20 -85.66 141.79 29.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.652 0.739 . . . . 51.450000000000003 112.096 -169.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -155.59 133.72 11.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.844 -1.071 . . . . 64.510000000000005 108.452 171.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.476 ' HG3' ' OE1' ' A' ' 24' ' ' GLU . 3.7 mptp? -80.08 115.91 19.91 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.0 0.428 . . . . 74.239999999999995 110.961 -176.37 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.788 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 56.5 t80 -83.54 -52.99 0.58 Allowed Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.606 -0.724 . . . . 74.340000000000003 110.147 177.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.788 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 83.9 Cg_endo -98.62 -159.18 0.04 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.836 2.357 . . . . 71.109999999999999 111.907 173.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 m -114.93 104.3 11.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.361 -0.382 . . . . 75.010000000000005 110.296 177.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 11.8 p -126.13 133.37 24.88 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.19 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 23.0 Cg_exo -64.8 -41.5 18.1 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.86 2.373 . . . . 74.140000000000001 112.972 -179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 97' ' ' ASP . 9.4 p -85.84 -172.71 4.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.229 -0.441 . . . . 54.299999999999997 111.004 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.786 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 44.4 mttp -108.88 19.0 20.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.737 0.303 . . . . 44.210000000000001 110.461 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.532 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 23.3 t -98.71 101.08 12.38 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.95 -0.759 . . . . 51.399999999999999 108.95 176.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.476 ' OE1' ' HG3' ' A' ' 15' ' ' LYS . 49.3 tt0 -129.86 140.25 51.03 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.624 -0.716 . . . . 73.049999999999997 110.655 -173.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 2.1 tm? -104.55 109.0 20.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.613 -0.721 . . . . 65.109999999999999 109.086 179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.81 123.07 49.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.155 0.503 . . . . 72.219999999999999 111.597 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.6 p -119.62 123.95 71.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.806 -0.634 . . . . 73.310000000000002 110.203 176.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 6.7 tp10 -110.46 126.2 54.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.847 -0.615 . . . . 72.140000000000001 109.864 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.537 HG21 ' HA ' ' A' ' 117' ' ' GLN . 4.0 mp -98.43 119.59 46.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.999 -0.546 . . . . 63.32 110.949 -174.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 88.4 mt -109.09 121.7 45.71 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 62.509999999999998 109.698 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -66.11 -17.37 64.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.869 -0.605 . . . . 71.430000000000007 111.382 -175.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.702 ' H ' ' HD2' ' A' ' 32' ' ' LYS . 2.0 mptp? -66.26 -16.91 64.41 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.083 -0.508 . . . . 65.299999999999997 111.433 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.49 41.65 1.72 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.617 -0.801 . . . . 34.219999999999999 112.118 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 45.1 tp60 -152.38 136.98 16.89 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.938 -0.764 . . . . 75.340000000000003 108.938 179.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 80' ' ' MET . 14.6 p -100.92 131.21 49.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.356 0.598 . . . . 64.310000000000002 110.87 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.55 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 4.9 tpp180 -102.67 109.7 21.39 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.551 -0.907 . . . . 71.239999999999995 108.551 175.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 20.7 t80 -132.93 129.08 37.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.998 0.427 . . . . 50.140000000000001 111.402 -173.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.578 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 68.1 p-90 -150.83 152.64 34.04 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.704 -0.68 . . . . 64.120000000000005 109.941 175.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.499 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 21.1 ptm -128.79 139.0 52.39 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.024 0.44 . . . . 73.299999999999997 110.382 176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.532 ' O ' ' HA ' ' A' ' 23' ' ' SER . 58.8 tt0 -98.04 130.53 44.85 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.499 -0.773 . . . . 74.420000000000002 109.741 179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -127.17 131.93 50.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.945 0.402 . . . . 64.430000000000007 110.658 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.786 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.2 pt-20 -86.42 -12.52 48.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.932 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.546 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 34.0 mmtp -123.03 146.31 47.76 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.105 -0.702 . . . . 61.149999999999999 109.105 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 42.8 mt -108.77 -86.08 0.52 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.918 -0.313 . . . . 75.239999999999995 110.843 -176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.4 t -114.62 111.38 21.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.089 -0.337 . . . . 53.149999999999999 110.089 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.7 p -165.38 -97.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.86 0.362 . . . . 72.129999999999995 110.897 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -128.36 -19.68 3.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.3 -0.409 . . . . 75.109999999999999 110.836 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -79.77 97.78 6.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.858 0.361 . . . . 74.230000000000004 110.568 -179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -101.88 137.91 39.54 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.125 -0.488 . . . . 73.25 110.346 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.7 p -97.8 121.96 48.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.442 0.639 . . . . 73.209999999999994 109.875 177.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.535 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 11.1 m -83.5 108.39 16.61 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.498 -0.774 . . . . 74.319999999999993 110.432 -178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 -75.95 89.2 2.94 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.419 -0.585 . . . . 71.239999999999995 109.419 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -110.92 130.38 64.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.436 0.636 . . . . 74.340000000000003 111.556 -173.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -128.39 105.93 8.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.541 -0.911 . . . . 64.140000000000001 108.541 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.424 ' O ' ' HG2' ' A' ' 57' ' ' LYS . 15.5 t-20 58.35 50.55 9.39 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.507 0.67 . . . . 72.540000000000006 110.087 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 67.22 7.64 5.63 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.121 -0.945 . . . . 71.230000000000004 112.539 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 24.7 mmtp -108.17 140.45 41.36 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.326 -0.25 . . . . 64.340000000000003 110.326 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.46 131.52 38.0 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.763 -0.828 . . . . 74.340000000000003 108.763 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 20.9 pt -109.37 177.81 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.848 0.832 . . . . 53.409999999999997 112.969 -172.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -146.08 161.63 39.71 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.436 -1.256 . . . . 72.319999999999993 109.44 -174.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 34.8 tt0 -79.51 143.31 34.99 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.751 -0.463 . . . . 71.540000000000006 109.751 178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.415 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.81 -122.2 0.62 Allowed Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.318 -0.944 . . . . 44.109999999999999 112.502 -177.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.415 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 14.6 Cg_exo -68.75 -65.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.009 2.473 . . . . 74.340000000000003 112.625 -177.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.434 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 66.5 tttt -80.93 -39.9 25.42 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.959 0.409 . . . . 72.019999999999996 110.636 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -81.14 129.72 34.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.617 -0.72 . . . . 73.519999999999996 111.167 -170.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.491 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 12.5 mmtm -138.32 116.61 11.9 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.066 -0.97 . . . . 64.040000000000006 108.677 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 66.9 mtm -120.82 124.12 44.28 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.802 0.334 . . . . 71.409999999999997 110.603 -172.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -96.45 114.41 26.08 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.698 -0.853 . . . . 74.239999999999995 108.698 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.546 HG12 ' HD2' ' A' ' 71' ' ' ARG . 10.6 tt -109.24 108.51 25.51 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.532 0.682 . . . . 73.299999999999997 110.282 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -104.62 125.05 50.38 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.452 -0.795 . . . . 73.25 110.868 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.546 ' HD2' HG12 ' A' ' 69' ' ' ILE . 2.2 mpp_? -109.5 12.47 24.46 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.025 -0.534 . . . . 74.209999999999994 110.722 178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -95.14 -44.0 7.85 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.831 -0.433 . . . . 71.510000000000005 109.831 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.1 m -109.33 -53.62 2.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.01 -0.541 . . . . 52.530000000000001 110.259 -178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 124.26 36.35 0.62 Allowed Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.705 -0.759 . . . . 74.25 112.619 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.1 mm -118.16 112.82 39.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.86 0.362 . . . . 71.239999999999995 110.161 179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 71.9 mt -101.43 122.04 53.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.305 -0.628 . . . . 75.310000000000002 109.305 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -115.69 155.4 27.79 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.422 -0.354 . . . . 74.120000000000005 110.825 -173.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.491 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 20.9 ttt -135.27 121.1 19.68 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.706 -0.479 . . . . 70.0 109.706 178.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -120.15 116.98 26.74 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.227 -0.442 . . . . 75.129999999999995 110.144 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.472 ' O ' HG12 ' A' ' 35' ' ' VAL . 63.6 mtm -142.01 158.35 43.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.343 -0.39 . . . . 63.299999999999997 110.71 -177.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.465 ' HG3' ' H ' ' A' ' 82' ' ' LYS . 5.3 pt-20 -129.76 -62.8 0.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.225 -0.443 . . . . 64.420000000000002 110.573 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.465 ' H ' ' HG3' ' A' ' 81' ' ' GLU . 0.0 OUTLIER 175.03 154.05 0.14 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 122.693 0.397 . . . . 64.439999999999998 109.934 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 84' ' ' GLN . 1.1 tm? -132.76 -70.0 0.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.398 -0.593 . . . . 71.329999999999998 109.398 173.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.584 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 26.4 mt-30 -100.68 -172.52 2.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.249 -0.432 . . . . 64.150000000000006 110.74 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -80.32 -52.23 7.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.95 -0.568 . . . . 75.129999999999995 110.556 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.24 7.1 4.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.504 0.669 . . . . 73.329999999999998 110.3 179.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.584 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 38.4 t70 -69.05 -13.35 62.39 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.724 -1.125 . . . . 64.209999999999994 111.994 -174.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -100.82 140.69 34.75 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.815 -0.439 . . . . 72.030000000000001 109.815 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.416 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -163.5 -138.02 2.32 Favored Glycine 0 CA--C 1.521 0.447 0 C-N-CA 119.837 -1.173 . . . . 42.329999999999998 114.256 -175.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 107' ' ' VAL . 19.9 m -114.08 121.62 44.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.885 0.374 . . . . 74.450000000000003 111.748 -173.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -103.1 139.97 37.93 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.987 -0.551 . . . . 61.030000000000001 109.658 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.698 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 26.2 m -143.66 105.9 4.4 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.903 0.382 . . . . 75.230000000000004 110.664 178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -96.62 118.9 34.08 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.881 0.372 . . . . 72.349999999999994 110.298 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.535 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 23.8 tm0? -106.64 117.05 33.04 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.71 -0.677 . . . . 72.239999999999995 109.655 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 51.6 mt -125.42 145.26 33.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.081 -0.711 . . . . 72.510000000000005 109.081 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.598 ' HA ' HG22 ' A' ' 101' ' ' THR . 57.9 tt0 -109.55 125.66 52.75 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.577 -0.449 . . . . 73.120000000000005 110.356 175.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.529 ' HB3' HG21 ' A' ' 21' ' ' THR . 2.2 m-20 -109.54 -163.32 0.86 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.283 -0.871 . . . . 72.140000000000001 110.164 -175.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.63 88.92 0.44 Allowed Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.397 -0.681 . . . . 43.530000000000001 111.397 174.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.4 mtpt 76.59 -29.49 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.793 0.837 . . . . 71.219999999999999 111.28 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.09 169.93 10.45 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.355 -0.384 . . . . 73.430000000000007 110.046 176.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 96' ' ' GLN . 0.8 OUTLIER -132.87 113.12 12.52 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.674 0.273 . . . . 54.009999999999998 110.826 173.152 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.17 89.02 0.49 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.578 -0.609 . . . . 64.420000000000002 111.578 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 p-80 -119.35 135.64 54.63 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.796 -0.446 . . . . 71.319999999999993 109.796 -177.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.4 t -136.01 127.46 28.6 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 120.771 0.32 . . . . 74.530000000000001 110.326 -179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 41.3 m -103.81 118.92 37.83 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.363 -0.606 . . . . 72.530000000000001 109.363 174.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.4 tm? -127.03 109.31 11.76 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.168 -0.679 . . . . 72.329999999999998 109.168 -177.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.427 ' HB ' HG23 ' A' ' 90' ' ' THR . 3.1 p -108.69 120.84 60.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.093 0.473 . . . . 54.399999999999999 111.367 -176.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 94.1 mt -123.5 103.42 8.44 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.096 -0.502 . . . . 73.409999999999997 109.77 175.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.416 HG12 ' HA2' ' A' ' 89' ' ' GLY . 32.4 mt -144.62 126.75 10.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 C-N-CA 121.135 -0.226 . . . . 74.510000000000005 110.544 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.11 -110.84 0.54 Allowed Glycine 0 CA--C 1.52 0.352 0 O-C-N 123.935 0.772 . . . . 71.409999999999997 114.273 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -70.11 -23.37 63.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.356 -0.422 . . . . 63.43 111.292 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.45 -55.77 14.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.344 -0.389 . . . . 71.319999999999993 111.092 -177.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.587 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 19.8 p90 -65.24 -35.7 81.86 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 120.367 -0.533 . . . . 71.439999999999998 111.946 -174.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.31 -35.69 81.03 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.985 -0.286 . . . . 73.109999999999999 111.281 -174.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -68.6 -44.24 74.74 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.757 -0.46 . . . . 65.019999999999996 109.757 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.71 -32.53 74.05 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.771 . . . . 72.019999999999996 110.934 -178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 113' ' ' TYR . 97.7 mt-30 -62.34 -46.87 86.76 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.429 -0.35 . . . . 74.129999999999995 111.075 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -72.59 -22.16 61.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.428 -0.351 . . . . 72.420000000000002 111.563 -177.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.95 -11.94 58.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.902 0.382 . . . . 73.530000000000001 110.376 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.45 -67.01 0.88 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.859 -0.609 . . . . 51.149999999999999 109.962 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -103.2 116.41 32.42 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.166 0.508 . . . . 75.219999999999999 109.879 175.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.484 -0.769 . . . . 72.209999999999994 110.451 -175.245 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 110.067 -0.346 . . . . 74.420000000000002 110.067 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -118.45 106.17 12.43 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.968 0.414 . . . . 75.349999999999994 110.408 175.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.514 ' OE2' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -93.13 164.94 13.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.813 -0.63 . . . . 72.409999999999997 109.333 174.249 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -66.65 -24.48 66.3 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.149 -0.22 . . . . 74.430000000000007 111.252 -176.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HE2' ' HD2' ' A' ' 79' ' ' PHE . 68.0 tttt -66.94 -28.25 68.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.841 0.353 . . . . 71.519999999999996 110.271 -179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.514 ' HB2' ' OE2' ' A' ' 3' ' ' GLU . 45.9 ttt180 -57.76 -38.06 74.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.329 0.585 . . . . 74.209999999999994 109.894 172.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.2 mp -77.78 -26.63 49.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.528 -0.76 . . . . 71.0 110.603 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -72.31 -19.95 61.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.316 -0.402 . . . . 62.140000000000001 110.54 176.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.79 -41.26 11.96 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 109.984 174.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.443 ' HA ' ' OE2' ' A' ' 77' ' ' GLU . 3.2 tm? -51.77 117.94 3.05 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.443 -0.798 . . . . 72.140000000000001 111.087 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.1 t -117.14 -175.61 2.83 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 75.439999999999998 110.467 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -76.68 125.55 29.45 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.389 -0.596 . . . . 61.0 109.389 176.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.9 32.48 0.9 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.808 0.67 . . . . 72.109999999999999 112.808 -165.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -155.26 109.34 2.89 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.597 -0.441 . . . . 73.230000000000004 111.792 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HZ2' ' HB2' ' A' ' 26' ' ' ALA . 30.1 mtmm -91.72 -162.24 0.9 Allowed 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.641 -0.503 . . . . 75.420000000000002 109.641 170.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.569 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 86.5 m-85 -107.12 -47.67 0.11 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.295 -0.411 . . . . 73.340000000000003 110.926 172.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -75.78 49.9 2.6 Favored 'Trans proline' 0 C--N 1.359 1.116 0 C-N-CA 122.364 2.043 . . . . 74.430000000000007 111.854 173.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 19' ' ' VAL . 13.8 m -81.16 170.67 15.85 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.461 -0.791 . . . . 63.009999999999998 110.015 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.459 ' N ' HG22 ' A' ' 18' ' ' THR . 27.2 m -96.89 166.5 13.8 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 109.66 -0.496 . . . . 72.230000000000004 109.66 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -72.38 30.96 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.338 2.692 . . . . 73.530000000000001 113.112 -177.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.437 HG22 ' OE1' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -143.0 -172.08 3.59 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.027 -1.101 . . . . 73.049999999999997 108.027 179.078 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 71.8 mmtt -106.93 30.53 6.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.467 0.651 . . . . 75.450000000000003 109.656 175.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.579 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 45.4 t -99.21 66.42 1.51 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.309 -0.859 . . . . 74.310000000000002 109.117 176.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.502 ' O ' ' HA ' ' A' ' 39' ' ' MET . 7.6 tp10 -75.54 105.19 6.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.366 -0.834 . . . . 64.0 110.446 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 104' ' ' SER . 3.4 tm? -106.9 126.2 52.0 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.275 -0.639 . . . . 70.299999999999997 109.275 177.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.497 ' HB2' ' HZ2' ' A' ' 15' ' ' LYS . . . -150.46 159.79 44.23 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.001 0.429 . . . . 75.099999999999994 110.968 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.4 p -143.04 118.62 4.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.695 -0.684 . . . . 64.420000000000002 110.061 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.449 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 30.5 mm-40 -109.69 125.95 53.18 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.771 -0.65 . . . . 53.43 109.271 -177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 65.2 mt -107.6 123.46 62.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 120.956 0.408 . . . . 71.319999999999993 111.288 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -98.71 129.96 45.18 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.186 -1.042 . . . . 65.129999999999995 108.186 173.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.528 ' HG3' ' HD2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -65.99 -5.48 9.66 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.191 0.441 . . . . 71.030000000000001 112.191 -168.495 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.528 ' HD2' ' HG3' ' A' ' 31' ' ' GLU . 22.3 mmmt -84.16 3.4 35.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.909 0.385 . . . . 54.329999999999998 110.628 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.91 24.89 26.26 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.874 -0.679 . . . . 71.120000000000005 112.133 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -119.59 110.98 17.5 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.303 -0.629 . . . . 74.439999999999998 109.303 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.421 ' HB ' ' HB2' ' A' ' 80' ' ' MET . 59.8 t -95.12 125.19 47.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 71.310000000000002 111.239 -176.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 3.3 tpp180 -97.75 110.54 23.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.628 -0.714 . . . . 74.319999999999993 109.274 175.031 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.48 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 56.6 t80 -118.58 133.17 56.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.901 -0.407 . . . . 75.019999999999996 109.901 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 31.8 p-90 -148.22 142.67 26.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.185 -0.461 . . . . 73.239999999999995 110.74 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 24' ' ' GLU . 23.9 ptt? -149.35 132.72 16.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.494 0.664 . . . . 73.319999999999993 111.197 -179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.579 ' O ' ' HA ' ' A' ' 23' ' ' SER . 34.9 tt0 -102.04 142.96 32.49 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.211 -0.904 . . . . 75.120000000000005 111.061 -177.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.432 ' O ' ' HA3' ' A' ' 74' ' ' GLY . . . -133.16 125.22 29.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.676 -0.693 . . . . 63.240000000000002 109.252 172.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.775 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 9.9 pt-20 -74.95 -16.59 60.64 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 111.924 0.342 . . . . 75.120000000000005 111.924 -176.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.535 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 31.0 mmtp -128.51 158.69 37.7 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.707 -0.479 . . . . 74.010000000000005 109.707 -179.155 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 44' ' ' LEU . 2.7 mm? -107.87 -50.0 3.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.712 -0.477 . . . . 64.230000000000004 109.712 -176.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.4 m -102.4 119.26 38.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.285 -0.416 . . . . 61.539999999999999 110.231 177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.2 p -175.7 -175.87 0.81 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.619 0.247 . . . . 40.020000000000003 110.716 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.88 -0.49 43.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.432 -0.349 . . . . 63.130000000000003 111.109 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -69.68 103.76 2.22 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.086 -0.506 . . . . 61.200000000000003 110.018 177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 10.2 ptpp? -104.5 137.27 42.61 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.243 -0.435 . . . . 75.519999999999996 110.165 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 p -117.36 110.74 32.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 73.430000000000007 110.352 175.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 61.1 m -89.27 116.6 27.62 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.965 -0.561 . . . . 74.109999999999999 110.732 -178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.434 ' HD1' ' CE2' ' A' ' 93' ' ' PHE . 50.9 m-85 -81.37 92.18 6.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.361 -0.607 . . . . 65.239999999999995 109.361 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.543 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.4 mm -106.8 125.26 62.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.266 0.555 . . . . 74.420000000000002 111.811 -173.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 59' ' ' ILE . 61.1 t80 -126.57 112.31 15.38 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.514 -0.766 . . . . 75.040000000000006 109.215 170.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 4.0 t-20 56.89 45.44 21.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.926 0.393 . . . . 63.530000000000001 109.964 179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.7 mt-10 77.81 -19.57 0.43 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.258 -0.883 . . . . 72.450000000000003 112.096 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 66.3 mmtt -88.88 134.53 33.92 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.686 0.279 . . . . 73.430000000000007 111.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.439 ' HG3' HD13 ' A' ' 53' ' ' ILE . 2.8 mt-10 -76.5 124.08 27.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.448 -0.575 . . . . 73.219999999999999 109.448 171.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG21 ' HB3' ' A' ' 54' ' ' PHE . 14.6 pt -108.91 175.68 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 113.19 0.811 . . . . 75.549999999999997 113.19 -167.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -135.97 161.17 36.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.861 -1.063 . . . . 73.329999999999998 109.304 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CG ' ' H ' ' A' ' 67' ' ' MET . 1.6 tm-20 -73.08 136.88 44.98 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.592 -0.522 . . . . 74.140000000000001 109.592 179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -172.15 -98.17 0.11 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.891 -0.671 . . . . 62.009999999999998 112.424 -176.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -92.03 -61.92 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.77 2.314 . . . . 72.530000000000001 113.574 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.578 ' HG2' ' OD1' ' A' ' 87' ' ' ASP . 5.7 tmtm? -71.97 -52.88 14.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.541 . . . . 73.200000000000003 111.567 -169.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.432 ' CD2' ' HD2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -105.19 129.5 53.56 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.118 -0.492 . . . . 74.239999999999995 110.74 -171.914 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -101.9 114.69 29.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.925 -0.768 . . . . 71.0 108.925 169.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.428 ' H ' ' CG ' ' A' ' 61' ' ' GLU . 69.4 mtm -123.72 120.58 33.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.386 -0.37 . . . . 72.150000000000006 110.339 -176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.8 m-70 -124.02 115.9 21.96 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.894 -0.41 . . . . 72.200000000000003 109.894 178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 37.7 pt -90.46 160.33 2.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.067 -0.515 . . . . 73.430000000000007 111.099 -178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -129.48 150.75 50.69 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.852 -0.613 . . . . 74.319999999999993 109.874 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 63.7 mtp180 -128.88 9.74 5.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.434 -0.348 . . . . 74.0 111.28 -179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -96.86 -30.56 13.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 70.349999999999994 110.298 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.6 p -135.14 -37.78 0.78 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 72.010000000000005 111.02 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 41' ' ' ALA . . . 111.93 41.33 1.1 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.857 -0.687 . . . . 71.340000000000003 112.0 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.5 mm -109.34 117.33 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 O-C-N 122.648 -0.324 . . . . 74.120000000000005 110.384 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 55.5 mt -123.18 109.64 24.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.886 0.374 . . . . 74.5 110.095 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HA ' ' A' ' 10' ' ' LEU . 3.8 mm-40 -110.19 143.59 40.08 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.018 -0.537 . . . . 72.530000000000001 109.937 -176.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 59.4 ttp -125.86 129.82 50.12 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.308 0.575 . . . . 75.150000000000006 111.176 176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.471 ' HD2' ' HE2' ' A' ' 5' ' ' LYS . 0.7 OUTLIER -113.1 113.22 25.1 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.631 -0.878 . . . . 71.540000000000006 108.631 177.496 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.421 ' HB2' ' HB ' ' A' ' 35' ' ' VAL . 68.0 mtm -102.64 131.78 49.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.157 0.504 . . . . 72.209999999999994 112.074 -175.194 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -125.75 -165.84 1.48 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.847 -1.07 . . . . 73.120000000000005 108.297 175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' O ' ' HD3' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -140.87 147.19 38.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.719 0.69 . . . . 72.519999999999996 111.729 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 54.3 tp -120.47 -49.13 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.919 -0.582 . . . . 62.229999999999997 111.499 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 16.4 mm100 -109.42 -174.54 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.447 0.536 . . . . 71.109999999999999 112.447 -174.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 87' ' ' ASP . 6.9 m-20 -78.86 -46.6 18.26 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.566 -0.743 . . . . 73.439999999999998 110.696 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.01 6.08 5.74 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.722 -0.672 . . . . 75.219999999999999 110.531 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.578 ' OD1' ' HG2' ' A' ' 64' ' ' LYS . 10.7 t70 -58.05 -39.23 77.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.608 -1.178 . . . . 73.530000000000001 111.921 -173.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.423 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 1.4 tp10 -85.95 136.44 33.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.817 -0.629 . . . . 73.209999999999994 110.518 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -157.27 -144.86 4.05 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.656 -0.783 . . . . 71.510000000000005 113.143 -178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 8.0 m -103.53 115.95 31.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.645 0.26 . . . . 70.400000000000006 110.809 -178.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.423 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 18.8 m-85 -103.87 132.51 50.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.981 -0.377 . . . . 70.239999999999995 109.981 -177.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.543 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 41.4 m -143.65 105.41 4.33 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.297 0.57 . . . . 70.450000000000003 110.879 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.434 ' CE2' ' HD1' ' A' ' 52' ' ' TYR . 52.8 m-85 -108.65 102.26 11.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.057 -0.52 . . . . 62.299999999999997 109.661 177.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -103.6 121.36 42.75 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.71 -0.677 . . . . 63.32 110.568 -173.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 4.6 mp -108.9 123.56 64.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.78 -0.645 . . . . 63.219999999999999 109.876 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 40.4 tt0 -93.16 111.87 23.64 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.427 -0.351 . . . . 75.239999999999995 110.497 -179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 20.0 t70 -109.18 163.03 13.72 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.671 -0.492 . . . . 64.340000000000003 109.671 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -68.94 -42.18 79.1 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.274 -0.489 . . . . 74.349999999999994 113.178 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.3 mttp -126.19 1.42 7.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.907 0.384 . . . . 54.210000000000001 111.769 -175.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -130.61 168.1 17.66 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.967 -0.56 . . . . 73.420000000000002 109.574 173.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 23.6 m -144.01 115.73 8.21 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.815 -0.439 . . . . 54.200000000000003 109.815 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -119.92 134.6 10.6 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.555 -0.831 . . . . 52.229999999999997 111.728 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -144.69 132.48 21.22 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.093 0.473 . . . . 72.530000000000001 110.472 178.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.669 ' HB2' HD11 ' A' ' 25' ' ' LEU . 18.8 t -97.58 97.41 9.03 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.189 -0.671 . . . . 45.299999999999997 109.189 176.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 24.0 m -106.87 118.91 37.93 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.715 -0.476 . . . . 65.140000000000001 109.715 178.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 63.2 tp -146.3 129.78 16.86 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.202 -0.453 . . . . 74.010000000000005 110.311 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -113.2 122.72 67.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 120.991 0.424 . . . . 63.009999999999998 110.122 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.542 HD22 ' HA ' ' A' ' 113' ' ' TYR . 78.6 mt -126.17 107.17 10.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.805 0.336 . . . . 61.25 110.146 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.78 127.08 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.128 -0.487 . . . . 63.329999999999998 110.204 177.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 53.88 -122.18 21.78 Favored Glycine 0 N--CA 1.449 -0.459 0 O-C-N 123.652 0.595 . . . . 62.340000000000003 112.951 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 19.6 t70 -61.41 -39.47 90.86 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 122.464 0.306 . . . . 60.450000000000003 111.562 -178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.9 t -59.95 -34.96 58.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.227 0.537 . . . . 72.450000000000003 110.867 -177.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HA ' HD22 ' A' ' 108' ' ' LEU . 18.7 t80 -71.09 -34.81 71.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 111.528 -177.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -84.1 -20.65 32.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.09 0.471 . . . . 62.219999999999999 110.266 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 49.8 tttp -55.03 -54.94 36.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.431 -0.804 . . . . 54.420000000000002 111.02 177.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -64.89 -32.07 73.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.912 -0.586 . . . . 64.209999999999994 111.636 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 77.5 mm-40 -55.87 -54.34 45.75 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.039 0.447 . . . . 74.129999999999995 111.225 -176.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 0.1 OUTLIER -83.0 -20.29 35.36 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.05 -0.523 . . . . 73.030000000000001 112.19 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -77.45 -22.91 50.69 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.329 -0.548 . . . . 73.109999999999999 110.255 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -86.08 -55.82 3.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.029 -0.532 . . . . 74.329999999999998 110.092 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 26.1 mt-10 -109.69 118.76 37.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.25 -0.432 . . . . 70.239999999999995 110.622 176.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.487 -0.768 . . . . 72.340000000000003 109.478 178.402 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.131 0.491 . . . . 71.140000000000001 110.013 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -102.98 164.71 11.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.969 -0.559 . . . . 73.5 110.669 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -135.28 152.88 51.93 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.034 -0.53 . . . . 65.510000000000005 110.279 -178.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.7 tpt -70.64 -20.92 62.68 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.0 -0.546 . . . . 75.150000000000006 111.37 -173.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -63.32 -37.66 88.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.451 . . . . 74.120000000000005 111.191 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.688 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 12.0 mmt180 -79.03 -16.11 57.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.372 . . . . 75.239999999999995 110.767 -178.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.521 ' O ' HD13 ' A' ' 7' ' ' LEU . 3.0 tm? -76.19 -25.04 54.77 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.009 -0.541 . . . . 75.230000000000004 109.79 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.9 mt -57.55 -12.13 2.52 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.613 -0.722 . . . . 71.340000000000003 112.876 -177.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.408 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -64.85 -34.8 79.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.749 0.309 . . . . 62.439999999999998 111.083 177.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.5 tp -70.35 128.39 36.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.961 -0.563 . . . . 65.140000000000001 111.016 -179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.433 ' HB3' ' OE1' ' A' ' 12' ' ' GLN . 50.0 m -145.03 -96.41 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.307 -0.406 . . . . 74.430000000000007 110.841 177.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.482 ' H ' ' HZ3' ' A' ' 38' ' ' TRP . 0.5 OUTLIER -169.44 120.81 0.71 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.232 0.539 . . . . 73.540000000000006 110.914 178.566 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 16.0 mp0 -85.44 136.08 33.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.849 -0.614 . . . . 70.340000000000003 109.864 -178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -173.38 60.82 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.87 0.367 . . . . 75.340000000000003 110.615 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.435 ' HE2' ' HB1' ' A' ' 26' ' ' ALA . 57.9 mttp -92.39 166.98 12.29 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.894 0.378 . . . . 62.520000000000003 111.208 174.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 95.5 m-85 -92.51 -50.87 0.28 Allowed Pre-proline 0 CA--C 1.536 0.42 0 CA-C-N 116.217 -0.447 . . . . 62.119999999999997 112.062 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 6.6 Cg_exo -74.16 60.13 4.66 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.306 2.004 . . . . 74.409999999999997 111.747 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.405 HG22 ' HG3' ' A' ' 24' ' ' GLU . 12.9 p -108.18 179.85 4.09 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.273 -0.876 . . . . 63.32 110.617 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 32.8 m -96.56 156.4 36.76 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-N 116.652 -0.249 . . . . 71.299999999999997 110.361 -177.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -63.45 -8.96 16.21 Favored 'Trans proline' 0 N--CA 1.477 0.551 0 C-N-CA 123.581 2.854 . . . . 64.120000000000005 114.635 -172.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.7 p -95.0 -111.51 0.13 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.802 -0.359 . . . . 50.119999999999997 111.357 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 61.1 mmtt -143.11 2.7 1.33 Allowed 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 111.752 0.278 . . . . 73.25 111.752 -178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.732 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 14.7 p -98.15 88.77 4.29 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-O 121.754 0.788 . . . . 71.25 112.198 -169.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.405 ' HG3' HG22 ' A' ' 18' ' ' THR . 35.9 tt0 -87.96 89.84 8.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 109.204 173.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.972 HD23 HD11 ' A' ' 95' ' ' ILE . 2.2 tm? -80.78 108.15 14.2 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.757 -1.201 . . . . 74.129999999999995 107.757 172.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.435 ' HB1' ' HE2' ' A' ' 15' ' ' LYS . . . -136.49 156.4 48.65 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.365 0.602 . . . . 61.520000000000003 111.048 -175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.1 p -118.43 130.45 73.25 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 115.247 -0.888 . . . . 71.430000000000007 108.797 174.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 36' ' ' ARG . 9.5 tp10 -108.65 119.44 39.55 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.349 -0.982 . . . . 75.5 108.349 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.506 ' CG2' ' HA ' ' A' ' 117' ' ' GLN . 4.4 mp -100.41 119.67 48.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.572 -0.74 . . . . 71.430000000000007 111.464 -167.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 82.8 mt -112.66 115.45 28.59 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.581 -0.896 . . . . 70.439999999999998 108.581 172.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.599 ' HA ' ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -69.14 2.07 3.11 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.54 0.571 . . . . 72.239999999999995 112.54 -169.215 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -82.13 -2.01 50.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.495 -0.32 . . . . 75.319999999999993 111.092 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 98.89 26.64 8.85 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.544 -0.836 . . . . 52.5 111.998 -179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.489 HE22 ' HB3' ' A' ' 81' ' ' GLU . 17.3 mm-40 -130.81 109.76 10.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.988 0.423 . . . . 72.25 109.92 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -99.46 126.58 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 74.299999999999997 110.965 -175.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.539 ' HB2' ' HB3' ' A' ' 28' ' ' GLU . 23.1 mtt180 -97.2 110.75 23.23 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.69 -0.686 . . . . 75.409999999999997 110.186 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.404 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 77.4 t80 -100.61 124.44 46.19 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.415 -0.957 . . . . 74.219999999999999 108.415 172.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.482 ' HZ3' ' H ' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -148.13 141.79 25.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.186 0.517 . . . . 71.150000000000006 111.484 -176.594 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.51 ' HB3' HD22 ' A' ' 25' ' ' LEU . 10.6 ptm -145.42 135.77 24.06 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 72.200000000000003 111.168 179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.732 ' O ' ' HA ' ' A' ' 23' ' ' SER . 7.9 tt0 -98.34 152.27 19.63 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.368 -0.833 . . . . 53.420000000000002 108.889 173.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.6 154.04 48.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.778 -0.452 . . . . 62.409999999999997 109.778 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG2' ' OD1' ' A' ' 97' ' ' ASP . 3.6 pt-20 -71.92 -24.53 61.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.582 -0.281 . . . . 64.129999999999995 111.69 -178.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.515 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 26.9 mmtp -126.22 152.98 45.33 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.824 0.345 . . . . 52.299999999999997 111.103 -173.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.649 HD12 ' HB3' ' A' ' 71' ' ' ARG . 0.8 OUTLIER -109.81 -4.41 16.06 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.05 -0.722 . . . . 73.540000000000006 109.05 174.454 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.0 t -72.96 162.27 29.7 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.766 -1.107 . . . . 70.409999999999997 110.077 175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.4 m -63.34 5.65 0.16 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.617 0.599 . . . . 50.109999999999999 112.617 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 35.7 t30 -64.78 -44.91 88.48 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.147 0.498 . . . . 65.140000000000001 110.277 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -87.39 96.37 10.34 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.741 -0.663 . . . . 73.019999999999996 110.786 -177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.422 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 48.2 mtpt -108.21 118.17 36.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.113 -0.494 . . . . 61.340000000000003 110.416 176.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -99.12 117.8 44.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.853 -0.612 . . . . 51.219999999999999 109.682 175.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.5 m -76.38 108.53 9.4 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.909 -0.587 . . . . 74.340000000000003 110.571 -178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -74.28 89.97 2.09 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.526 -0.546 . . . . 74.420000000000002 109.526 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.4 mm -108.79 129.44 63.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.219 0.533 . . . . 64.209999999999994 111.331 -174.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -128.16 114.98 17.69 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.224 -0.658 . . . . 70.209999999999994 109.224 173.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 58.91 35.49 24.18 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.583 0.552 . . . . 72.040000000000006 110.344 -179.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 71.99 11.69 6.09 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.496 -0.775 . . . . 64.549999999999997 112.003 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -112.81 147.08 37.69 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.431 -0.581 . . . . 65.219999999999999 109.431 176.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -80.0 140.29 36.64 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.103 -0.703 . . . . 74.329999999999998 109.103 176.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 23.0 pt -109.25 164.62 5.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 121.46 0.648 . . . . 75.150000000000006 112.202 -174.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 47.6 p90 -124.23 160.32 28.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.818 -1.083 . . . . 72.430000000000007 109.592 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.02 114.49 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.895 0.379 . . . . 74.430000000000007 110.406 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -126.79 -158.35 9.82 Favored Glycine 0 C--O 1.225 -0.448 0 C-N-CA 121.085 -0.579 . . . . 64.109999999999999 111.908 -178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -69.52 -21.91 33.92 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 122.413 2.075 . . . . 40.25 112.594 179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 64' ' ' LYS . 0.5 OUTLIER -94.19 -28.66 15.52 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.258 -0.428 . . . . 54.109999999999999 110.299 -178.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 91' ' ' TYR . 84.9 m-85 -113.01 133.12 55.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.102 -0.499 . . . . 74.439999999999998 111.368 -172.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.3 tptp -145.77 115.39 7.23 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.663 -0.495 . . . . 62.109999999999999 109.663 171.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.97 142.71 51.4 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.93 -0.396 . . . . 63.299999999999997 109.93 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.566 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 7.7 m-70 -101.37 132.59 46.86 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.958 -0.386 . . . . 72.530000000000001 109.958 -177.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.1 tt -136.48 93.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.95 0.881 . . . . 64.340000000000003 109.661 173.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -128.57 125.02 37.39 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.079 -0.964 . . . . 61.210000000000001 108.609 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.649 ' HB3' HD12 ' A' ' 44' ' ' LEU . 3.1 mpt_? -79.43 72.36 6.05 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.459 0.647 . . . . 70.510000000000005 111.23 -171.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.451 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.73 -56.86 2.38 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.121 -1.437 . . . . 72.129999999999995 107.121 167.534 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 p -136.41 175.18 9.84 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 113.996 -1.456 . . . . 55.439999999999998 108.425 170.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -75.15 74.75 1.4 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.583 -0.818 . . . . 65.420000000000002 111.801 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.402 HD13 ' HA ' ' A' ' 40' ' ' GLN . 35.1 mm -135.0 126.31 46.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 110.222 -0.288 . . . . 71.319999999999993 110.222 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.4 mt -137.89 114.51 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.051 -0.522 . . . . 74.400000000000006 109.836 177.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.566 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -124.33 152.53 42.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.424 0.63 . . . . 75.450000000000003 111.472 176.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 53.4 ttp -129.23 126.68 39.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.247 -0.888 . . . . 74.219999999999999 110.173 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.688 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 21.0 t80 -110.77 121.37 45.16 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.012 -0.54 . . . . 63.43 109.746 -176.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 65.9 mtm -133.98 156.14 48.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.355 0.598 . . . . 63.439999999999998 112.119 -174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.489 ' HB3' HE22 ' A' ' 34' ' ' GLN . 11.5 pt-20 -108.06 -168.46 1.37 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.067 -0.97 . . . . 75.430000000000007 108.453 170.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -99.51 145.99 26.87 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.812 -0.81 . . . . 64.310000000000002 108.812 174.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 83' ' ' LEU . 1.5 tm? -108.93 -74.26 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 107.966 -1.124 . . . . 64.400000000000006 107.966 175.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -157.25 162.13 39.21 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.318 -0.993 . . . . 55.420000000000002 108.318 173.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.54 -21.17 59.86 Favored 'General case' 0 C--N 1.323 -0.566 0 O-C-N 123.432 0.458 . . . . 72.409999999999997 111.17 -178.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.65 -36.27 57.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 74.230000000000004 111.629 177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.405 ' HB3' ' HB3' ' A' ' 83' ' ' LEU . 36.7 t70 -82.39 -35.66 27.49 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 109.41 -0.589 . . . . 65.340000000000003 109.41 -178.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.627 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.4 OUTLIER -66.59 154.11 41.31 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.939 -1.028 . . . . 72.409999999999997 109.752 170.695 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 176.81 -147.8 8.62 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.085 -1.055 . . . . 71.409999999999997 112.995 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 6.4 m -82.78 101.0 10.64 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.679 0.276 . . . . 73.310000000000002 111.682 -177.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.416 ' HE2' ' HE2' ' A' ' 65' ' ' TYR . 89.7 m-85 -87.62 134.55 33.62 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.199 -0.667 . . . . 72.010000000000005 109.199 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.472 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.4 m -138.53 128.89 25.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.845 0.355 . . . . 74.299999999999997 110.513 -178.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.65 129.01 42.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.971 0.415 . . . . 54.329999999999998 111.042 -178.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -120.94 120.94 36.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.732 -0.667 . . . . 62.240000000000002 109.646 175.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.972 HD11 HD23 ' A' ' 25' ' ' LEU . 40.6 mt -110.06 125.18 67.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.243 -0.435 . . . . 74.530000000000001 111.141 -178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -88.66 101.12 13.67 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.726 -0.842 . . . . 73.219999999999999 108.726 169.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.536 ' OD1' ' HG2' ' A' ' 42' ' ' GLU . 26.2 t70 -132.8 125.97 31.28 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.238 -0.437 . . . . 71.150000000000006 110.376 -175.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 64.76 -109.74 3.04 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.921 -0.656 . . . . 53.100000000000001 111.521 -176.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -132.43 20.9 4.34 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.521 -0.548 . . . . 75.209999999999994 109.521 174.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -125.7 162.33 25.29 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.645 -0.707 . . . . 74.230000000000004 110.178 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.9 m -118.35 114.69 23.33 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.331 -0.395 . . . . 61.140000000000001 110.301 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.81 114.17 3.84 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.471 -0.871 . . . . 61.210000000000001 111.228 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -108.6 133.22 53.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.896 0.348 . . . . 74.329999999999998 110.154 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 23.1 t -138.1 127.43 24.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.301 -0.409 . . . . 73.510000000000005 110.504 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.3 m -117.66 118.04 31.03 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.317 -0.623 . . . . 75.329999999999998 109.317 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.89 106.3 9.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.083 0.468 . . . . 51.530000000000001 109.807 -175.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -94.74 111.78 26.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.265 0.555 . . . . 72.239999999999995 110.575 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 86.8 mt -107.06 103.03 12.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.217 -0.447 . . . . 73.319999999999993 109.998 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 21.7 mt -151.18 127.9 2.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 N-CA-C 110.686 -0.116 . . . . 62.520000000000003 110.686 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.64 -123.41 8.71 Favored Glycine 0 C--N 1.332 0.353 0 O-C-N 123.553 0.533 . . . . 72.510000000000005 114.053 174.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.53 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 5.2 m-20 -62.99 -27.1 69.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.437 -0.382 . . . . 65.129999999999995 111.175 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 38.7 t -65.14 -46.37 91.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.195 -0.457 . . . . 73.530000000000001 111.001 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.637 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 1.2 p90 -77.62 -26.81 50.87 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 119.343 -0.943 . . . . 72.140000000000001 111.827 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.1 OUTLIER -73.49 -34.59 65.39 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 120.769 -0.372 . . . . 53.130000000000003 110.887 -175.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 18.3 ptmt -69.33 -36.92 77.42 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 120.421 -0.512 . . . . 72.219999999999999 110.253 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.89 -32.54 73.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.381 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 113' ' ' TYR . 70.4 mm-40 -65.06 -44.06 90.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.96 -0.564 . . . . 70.230000000000004 110.231 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.2 tptt -88.26 -21.34 24.53 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.763 -0.653 . . . . 75.230000000000004 111.765 -171.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 64.4 mt-10 -79.0 -20.48 48.96 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.923 0.392 . . . . 74.450000000000003 110.509 174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.415 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -82.94 -53.15 6.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.119 -0.491 . . . . 72.129999999999995 110.638 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -106.0 -163.93 0.97 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.273 -0.421 . . . . 74.439999999999998 110.387 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 23.2 p90 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.363 -0.827 . . . . 71.510000000000005 110.215 -179.055 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.273 -0.269 . . . . 71.239999999999995 110.273 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 56.71 27.83 13.27 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.521 0.677 . . . . 73.439999999999998 111.108 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.425 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 6.7 pt-20 -90.05 33.53 0.87 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.229 -0.896 . . . . 71.219999999999999 110.321 -177.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.6 ttm -58.52 -32.18 68.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.712 -0.677 . . . . 75.519999999999996 111.753 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.416 ' H ' ' HG2' ' A' ' 5' ' ' LYS . 44.6 pttt -68.58 -35.64 77.65 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.769 -0.196 . . . . 74.109999999999999 111.457 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.478 HH11 ' HB2' ' A' ' 66' ' ' LYS . 83.6 mtt180 -80.6 -19.78 44.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.881 0.372 . . . . 70.439999999999998 110.962 175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 tp -58.45 -23.8 58.54 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.722 -0.672 . . . . 44.350000000000001 111.411 -178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -53.84 -13.24 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.544 0.572 . . . . 65.420000000000002 112.544 178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.77 ' HB2' ' HB2' ' A' ' 79' ' ' PHE . . . -52.81 -49.32 65.9 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.969 0.414 . . . . 64.310000000000002 110.494 173.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 10' ' ' LEU . 2.0 tm? -89.39 88.37 7.45 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.823 -0.806 . . . . 73.099999999999994 108.823 176.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.407 ' HB2' ' NH1' ' A' ' 36' ' ' ARG . 33.8 t -78.52 -44.82 23.41 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.817 -0.628 . . . . 71.200000000000003 109.931 178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -166.49 149.98 7.17 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.874 -0.603 . . . . 62.340000000000003 109.807 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -103.87 29.33 5.91 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.725 0.774 . . . . 75.209999999999994 109.466 178.182 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 85.2 t60 -115.29 70.59 0.75 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.143 -0.935 . . . . 70.150000000000006 110.596 -177.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 17' ' ' PRO . 55.4 tptt -90.7 107.96 19.52 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.193 -0.669 . . . . 71.409999999999997 109.193 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.514 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 73.2 t80 -67.69 -53.38 22.02 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.268 -0.423 . . . . 75.239999999999995 111.704 -176.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HG2' ' HE3' ' A' ' 15' ' ' LYS . 54.9 Cg_endo -73.93 124.38 9.11 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 121.413 1.409 . . . . 73.010000000000005 111.196 173.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.465 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 6.6 t -137.02 178.92 6.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.992 0.425 . . . . 24.239999999999998 111.39 -175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.998 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -96.82 175.32 2.69 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 115.594 -0.73 . . . . 71.209999999999994 110.365 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.998 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 48.9 Cg_exo -26.52 -56.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.236 0 C-N-CA 125.132 3.888 . . . . 75.450000000000003 115.829 -176.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.3 m -98.13 -97.62 0.21 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.754 -0.378 . . . . 65.099999999999994 111.255 -177.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 48.8 mmtt -158.52 15.89 0.2 Allowed 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.116 0.484 . . . . 42.439999999999998 110.492 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 85.7 p -98.3 79.81 2.58 Favored 'General case' 0 N--CA 1.434 -1.236 0 CA-C-O 121.777 0.798 . . . . 72.299999999999997 108.992 -174.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.465 ' OE1' ' HA ' ' A' ' 18' ' ' THR . 28.3 tp10 -89.16 127.13 35.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.816 -1.084 . . . . 65.219999999999999 111.499 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' HB3' ' A' ' 39' ' ' MET . 2.0 tm? -104.58 108.46 19.92 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.392 -0.966 . . . . 73.140000000000001 108.392 175.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.68 105.16 14.31 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.11 0.481 . . . . 74.230000000000004 111.288 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.41 117.98 56.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.62 -0.718 . . . . 75.540000000000006 109.563 174.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -118.81 120.66 38.02 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.853 -0.612 . . . . 75.219999999999999 109.911 -177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.404 HG22 ' HG3' ' A' ' 117' ' ' GLN . 39.0 mt -92.68 125.59 45.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 116.164 -0.471 . . . . 64.510000000000005 110.574 -176.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -102.09 134.99 44.45 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.641 -0.504 . . . . 71.540000000000006 109.641 178.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HA ' ' CG ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.35 -3.38 42.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.38 0.609 . . . . 63.039999999999999 109.461 -179.373 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -9.12 28.64 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.114 -0.948 . . . . 54.549999999999997 110.33 173.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.04 35.14 5.89 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.038 -0.825 . . . . 41.420000000000002 111.038 -175.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.76 HE22 ' HB3' ' A' ' 81' ' ' GLU . 15.5 mm100 -141.78 160.34 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.795 0.331 . . . . 75.420000000000002 110.626 -176.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.95 125.78 49.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.297 0.57 . . . . 64.5 110.094 174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.407 ' NH1' ' HB2' ' A' ' 11' ' ' SER . 32.8 ttp180 -102.12 124.03 47.01 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.804 -0.634 . . . . 75.219999999999999 110.077 -178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.529 ' HD2' ' HB3' ' A' ' 78' ' ' MET . 56.9 t80 -131.31 125.21 32.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.15 -0.477 . . . . 72.549999999999997 111.35 -175.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.624 ' HH2' ' HB2' ' A' ' 15' ' ' LYS . 64.4 p-90 -151.36 156.02 39.87 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.188 -0.46 . . . . 61.340000000000003 109.945 170.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.512 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.5 ptm -138.64 145.09 40.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.087 0.47 . . . . 75.329999999999998 111.514 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 23' ' ' SER . 25.2 mt-30 -105.18 125.69 51.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.461 -0.79 . . . . 74.349999999999994 109.757 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -115.03 138.76 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.108 -0.33 . . . . 45.219999999999999 110.108 176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -30.52 34.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.043 0.449 . . . . 74.420000000000002 110.466 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.594 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 1.3 pptp? -145.35 109.15 4.74 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.422 -0.585 . . . . 72.450000000000003 109.422 169.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.564 HD13 ' O ' ' A' ' 44' ' ' LEU . 1.9 tm? -109.48 -8.55 15.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.883 0.849 . . . . 71.010000000000005 109.182 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.8 t -78.42 115.52 18.19 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.512 -0.767 . . . . 73.340000000000003 110.219 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m 74.76 -48.32 0.64 Allowed 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.532 0.733 . . . . 62.539999999999999 112.49 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -104.62 -174.54 2.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 110.313 -0.255 . . . . 71.340000000000003 110.313 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . 63.9 84.01 0.16 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.522 0.677 . . . . 73.409999999999997 111.216 -177.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HB2' ' HE2' ' A' ' 49' ' ' LYS . 23.6 ttmm -79.6 112.21 16.64 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.483 -0.78 . . . . 72.540000000000006 110.533 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.5 t -100.44 111.51 30.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.503 -0.555 . . . . 71.099999999999994 109.503 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 19.7 m -87.31 118.44 26.75 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.152 -0.476 . . . . 71.230000000000004 110.604 -177.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -91.0 89.23 7.34 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.295 -0.632 . . . . 64.420000000000002 109.295 178.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 92' ' ' THR . 47.8 mm -108.52 125.19 65.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.376 0.608 . . . . 53.420000000000002 111.636 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 59' ' ' ILE . 43.5 t80 -131.6 117.15 18.32 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.275 -0.875 . . . . 73.420000000000002 108.827 172.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 59.8 33.77 21.77 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.691 0.758 . . . . 63.439999999999998 109.549 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 69.31 16.29 8.39 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 114.942 -1.026 . . . . 63.240000000000002 112.007 179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -121.08 162.84 19.32 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.738 -0.468 . . . . 73.400000000000006 109.738 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -90.26 141.73 28.42 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.022 -0.362 . . . . 64.049999999999997 110.022 178.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG23 ' HB3' ' A' ' 54' ' ' PHE . 12.9 pt -109.54 151.46 11.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.305 0.574 . . . . 72.340000000000003 112.254 -175.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -131.09 161.11 32.79 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.995 -1.002 . . . . 71.230000000000004 109.486 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -67.05 147.85 52.66 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.895 0.379 . . . . 73.25 111.395 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.14 -143.44 4.37 Favored Glycine 0 N--CA 1.449 -0.474 0 N-CA-C 111.734 -0.547 . . . . 71.230000000000004 111.734 -178.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -75.96 -28.01 8.02 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.286 1.99 . . . . 74.109999999999999 112.159 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.405 ' HZ1' ' CD ' ' A' ' 88' ' ' GLU . 3.5 tmtm? -88.79 -42.62 11.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.89 -0.595 . . . . 74.310000000000002 110.246 -176.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -109.9 148.98 30.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.035 -0.53 . . . . 74.209999999999994 111.124 -174.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.478 ' HB2' HH11 ' A' ' 6' ' ' ARG . 17.3 tptp -145.09 117.19 8.34 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.145 -1.057 . . . . 54.219999999999999 108.145 172.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 26.2 ptt? -145.49 146.62 31.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.135 0.493 . . . . 63.210000000000001 112.157 -170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -129.37 134.62 47.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.541 -0.754 . . . . 73.040000000000006 110.077 175.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.553 HG13 HG12 ' A' ' 76' ' ' ILE . 6.4 tt -117.86 106.12 19.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 75.430000000000007 110.263 179.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -96.07 109.33 21.77 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.097 -0.502 . . . . 71.519999999999996 110.342 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.893 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -87.43 5.56 38.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.839 -0.618 . . . . 73.430000000000007 111.045 -178.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -89.34 -38.56 14.06 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.102 0.477 . . . . 73.129999999999995 109.808 -177.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -109.79 -29.86 8.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.809 -0.632 . . . . 72.109999999999999 111.103 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.36 31.84 5.71 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.601 -0.809 . . . . 62.229999999999997 112.056 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.2 mm -110.04 126.44 67.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.997 0.427 . . . . 70.0 110.497 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.553 HG12 HG13 ' A' ' 69' ' ' ILE . 60.1 mt -124.56 124.96 69.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.894 -0.594 . . . . 75.239999999999995 109.526 176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.78 149.99 51.28 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.602 0.239 . . . . 70.329999999999998 110.799 -178.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HD2' ' A' ' 37' ' ' PHE . 53.9 ttp -148.71 130.72 15.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.278 0.561 . . . . 74.329999999999998 111.15 176.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.77 ' HB2' ' HB2' ' A' ' 9' ' ' ALA . 25.5 t80 -109.83 122.75 48.23 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.223 -0.658 . . . . 75.400000000000006 109.223 177.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 69.4 mtm -120.77 142.16 49.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.287 -0.415 . . . . 71.099999999999994 110.738 -177.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.76 ' HB3' HE22 ' A' ' 34' ' ' GLN . 15.5 pt-20 -135.39 177.35 7.88 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.209 -0.663 . . . . 65.420000000000002 109.209 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.491 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.06 128.63 35.41 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.619 -0.511 . . . . 71.049999999999997 109.619 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -109.94 -63.97 1.31 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.782 -0.822 . . . . 75.209999999999994 108.782 179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -121.1 159.38 25.87 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.401 -0.818 . . . . 73.109999999999999 109.133 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -51.4 -34.92 36.65 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.91 0.484 . . . . 70.219999999999999 112.143 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -77.1 -40.83 44.5 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.703 1.001 . . . . 72.239999999999995 113.703 -172.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -73.59 -3.35 27.41 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.677 0.992 . . . . 72.150000000000006 113.677 -165.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.405 ' CD ' ' HZ1' ' A' ' 64' ' ' LYS . 3.2 tp10 -94.9 104.4 16.29 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.406 -0.59 . . . . 74.219999999999999 109.406 174.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -144.04 -142.88 3.98 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 120.497 -0.858 . . . . 62.409999999999997 113.969 -173.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 16.1 m -91.16 119.4 31.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.833 0.349 . . . . 75.200000000000003 111.533 -176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -103.71 140.06 38.12 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.149 -0.478 . . . . 71.299999999999997 110.056 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.487 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 27.8 m -137.93 108.15 6.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.037 0.446 . . . . 72.329999999999998 110.464 -178.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 90.7 m-85 -104.89 124.98 50.42 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.269 -0.423 . . . . 73.109999999999999 109.864 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -127.08 116.13 20.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.809 0.338 . . . . 73.349999999999994 110.555 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 55.1 mt -101.83 111.13 30.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 116.033 -0.531 . . . . 75.510000000000005 110.082 176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -92.56 110.09 21.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.934 0.397 . . . . 73.430000000000007 110.817 -179.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -108.61 -62.87 1.4 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.967 -0.56 . . . . 72.430000000000007 110.492 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 141.49 -42.71 1.14 Allowed Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 111.373 -0.691 . . . . 43.109999999999999 111.373 -177.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.971 ' HA ' ' HE3' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -83.27 -39.83 20.34 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.258 -0.645 . . . . 74.099999999999994 109.258 176.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -144.75 144.22 31.08 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.269 -0.878 . . . . 74.109999999999999 109.602 176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 22.1 p -103.12 113.42 26.89 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.956 0.408 . . . . 74.25 110.249 175.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.4 79.03 1.78 Allowed Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 111.031 -0.828 . . . . 72.150000000000006 111.031 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.438 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 40.6 p-80 -111.44 130.8 55.59 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.943 0.402 . . . . 62.32 110.783 -177.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 18.0 m -137.21 121.55 18.15 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.8 -0.636 . . . . 74.200000000000003 110.517 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -98.89 118.1 34.9 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.612 -0.514 . . . . 63.229999999999997 109.612 173.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -128.32 107.83 10.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.339 -0.615 . . . . 70.219999999999999 109.339 -177.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 2.8 p -98.51 115.68 39.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.062 -0.517 . . . . 64.299999999999997 111.216 -177.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.586 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 78.9 mt -112.84 101.23 9.32 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.719 -0.474 . . . . 72.409999999999997 109.719 176.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 17.6 mt -149.98 127.85 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.681 -0.236 . . . . 65.140000000000001 110.674 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.8 -119.97 3.45 Favored Glycine 0 CA--C 1.523 0.543 0 O-C-N 123.917 0.761 . . . . 62.030000000000001 114.754 171.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -74.63 -21.75 59.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.969 0.414 . . . . 63.219999999999999 111.359 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.85 -49.92 73.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 116.23 -0.441 . . . . 72.109999999999999 111.059 -178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.586 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 8.4 p90 -77.2 -28.48 53.93 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.612 -0.435 . . . . 75.519999999999996 112.154 -172.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -60.56 -35.34 75.81 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.12 -0.232 . . . . 73.319999999999993 111.465 -174.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.529 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 88.3 tttt -70.81 -51.43 26.81 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.828 -0.349 . . . . 71.540000000000006 110.219 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.4 ' HA ' ' OE1' ' A' ' 119' ' ' GLU . 9.9 mp -61.25 -32.87 72.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.241 -0.436 . . . . 65.329999999999998 110.735 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.504 ' CG ' ' HA ' ' A' ' 31' ' ' GLU . 35.7 tt0 -64.63 -41.06 96.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.838 -0.619 . . . . 73.200000000000003 110.914 178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.461 ' HD2' ' HA ' ' A' ' 118' ' ' LYS . 22.6 mmmt -78.75 -21.42 48.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 61.130000000000003 111.725 -178.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 46.7 mt-10 -64.24 -35.26 80.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.025 0.441 . . . . 63.32 110.153 174.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.6 -71.08 0.41 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.842 -0.617 . . . . 71.540000000000006 111.007 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -92.96 122.19 35.07 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.959 0.409 . . . . 53.32 111.496 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 64.8 t80 . . . . . 0 C--O 1.246 0.899 0 CA-C-N 115.555 -0.748 . . . . 74.120000000000005 109.487 175.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.139 -0.319 . . . . 74.510000000000005 110.139 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -91.15 90.89 8.0 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.455 -0.572 . . . . 61.109999999999999 109.455 172.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.32 109.42 18.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.433 -0.803 . . . . 75.129999999999995 110.644 -174.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.1 -36.39 83.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 72.200000000000003 110.886 -178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.432 ' HD3' ' H ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -68.08 -28.4 67.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.947 0.403 . . . . 72.239999999999995 110.671 -178.62 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.406 ' HD3' ' OE1' ' A' ' 77' ' ' GLU . 8.4 tpp180 -68.79 -34.14 75.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.948 -0.569 . . . . 73.319999999999993 110.415 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 83.6 mt -65.28 -25.4 67.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.764 -0.653 . . . . 73.019999999999996 111.395 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.03 -31.77 72.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.268 -0.424 . . . . 61.25 111.698 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.426 ' HB3' ' OE1' ' A' ' 77' ' ' GLU . . . -89.74 -42.74 11.14 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.022 -0.271 . . . . 63.25 110.89 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.1 tt -57.86 115.65 2.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 75.450000000000003 110.032 178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 m -116.14 -176.15 2.89 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.035 -0.529 . . . . 61.219999999999999 110.085 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -74.47 123.07 24.04 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.843 -0.428 . . . . 74.349999999999994 109.843 177.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.604 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 9.4 pt-20 -70.61 89.79 0.73 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.497 -0.774 . . . . 72.530000000000001 112.222 -172.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -98.05 122.74 41.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.594 -0.73 . . . . 75.450000000000003 110.466 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 15' ' ' LYS . 10.4 mptt -90.05 148.97 22.72 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.036 -0.529 . . . . 74.450000000000003 109.866 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 90.2 m-85 -104.99 -54.81 0.09 OUTLIER Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 111.956 0.354 . . . . 71.409999999999997 111.956 -178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 94.5 Cg_endo -99.61 -167.64 0.08 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.605 2.203 . . . . 64.0 112.951 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.6 m -97.29 102.51 14.3 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.315 -0.624 . . . . 61.310000000000002 109.315 173.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.628 HG22 HG22 ' A' ' 21' ' ' THR . 13.4 p -106.92 132.39 20.94 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.291 -0.413 . . . . 73.120000000000005 111.016 -176.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 6.3 Cg_exo -75.2 29.93 0.36 Allowed 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 123.66 2.907 . . . . 54.509999999999998 113.269 -179.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.628 HG22 HG22 ' A' ' 19' ' ' VAL . 8.9 t -156.01 -176.25 5.86 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.895 -0.78 . . . . 75.219999999999999 108.895 178.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -108.75 15.41 23.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.528 0.68 . . . . 74.319999999999993 109.985 -178.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.471 ' H ' HG23 ' A' ' 21' ' ' THR . 10.5 t -103.36 110.12 22.01 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.221 -0.9 . . . . 60.200000000000003 110.003 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.667 ' HB3' HE22 ' A' ' 40' ' ' GLN . 8.0 tp10 -107.17 145.3 32.74 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.064 -0.717 . . . . 75.109999999999999 109.064 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.487 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -107.11 108.82 20.47 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.787 -0.449 . . . . 73.129999999999995 109.787 -178.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -113.37 116.09 29.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.181 0.515 . . . . 72.420000000000002 111.355 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.9 p -120.14 119.06 58.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.684 -0.689 . . . . 72.209999999999994 109.816 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -120.13 135.85 54.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.168 -0.469 . . . . 74.25 110.826 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.433 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.1 mp -110.51 143.91 19.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.272 -0.64 . . . . 52.509999999999998 109.272 178.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 2.7 mm? -116.65 150.3 38.36 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.155 -0.683 . . . . 64.140000000000001 109.155 176.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.467 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.1 OUTLIER -70.83 -12.33 61.48 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.35 0.595 . . . . 65.420000000000002 110.83 -175.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.458 ' HG3' ' OE1' ' A' ' 31' ' ' GLU . 32.3 mtmm -86.11 20.49 2.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.673 -0.694 . . . . 73.340000000000003 110.863 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.428 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 69.3 36.69 79.27 Favored Glycine 0 C--O 1.225 -0.43 0 C-N-CA 120.955 -0.641 . . . . 72.310000000000002 112.077 178.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.711 ' HB2' ' HB2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -114.83 143.58 44.88 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.036 -0.357 . . . . 73.519999999999996 110.036 -179.296 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.7 p -127.68 120.4 54.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.52 0.676 . . . . 73.150000000000006 110.196 175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.422 ' HD2' ' O ' ' A' ' 9' ' ' ALA . 38.3 ttp180 -109.36 112.72 25.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.563 -0.744 . . . . 75.310000000000002 110.084 -178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 55.4 t80 -118.0 121.31 40.3 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.56 -0.745 . . . . 70.230000000000004 110.148 -176.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 64.4 p-90 -147.6 148.61 31.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.012 0.434 . . . . 61.549999999999997 110.973 178.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.6 ptm -145.64 149.59 34.79 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 110.046 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.667 HE22 ' HB3' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -100.61 160.2 14.54 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.904 0.383 . . . . 74.120000000000005 110.646 -178.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -140.93 144.17 35.02 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.561 -0.745 . . . . 71.010000000000005 109.042 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 8.0 pt-20 -68.74 -40.76 79.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.905 0.383 . . . . 73.209999999999994 111.127 -177.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.49 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 5.2 mptp? -127.4 179.14 5.63 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.253 -0.431 . . . . 75.519999999999996 110.627 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.509 ' HB2' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -107.19 -11.59 15.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.837 -0.62 . . . . 73.230000000000004 109.949 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.2 t -113.82 111.02 21.05 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.452 -0.944 . . . . 64.129999999999995 108.452 173.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.0 t -100.13 168.88 9.54 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.299 0.571 . . . . 72.409999999999997 111.452 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -83.59 -29.51 27.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.235 -0.893 . . . . 74.510000000000005 110.518 178.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' A' ' 96' ' ' GLN . . . -131.62 -160.31 1.04 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.043 -0.526 . . . . 70.519999999999996 110.871 -176.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -117.09 136.96 52.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.151 0.5 . . . . 71.230000000000004 111.76 -175.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.1 p -99.66 127.83 52.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.091 -0.707 . . . . 71.239999999999995 109.091 172.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.9 m -102.29 129.07 48.61 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.432 0.53 . . . . 40.140000000000001 112.432 -171.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -89.07 86.26 6.87 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.992 -0.744 . . . . 75.400000000000006 108.992 174.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.783 ' HB ' ' O ' ' A' ' 92' ' ' THR . 42.2 mm -106.23 129.71 59.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 71.109999999999999 112.094 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -124.42 106.53 10.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.54 -0.755 . . . . 71.439999999999998 109.055 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 56.8 59.69 3.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.814 -0.63 . . . . 62.409999999999997 110.37 -176.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 71.03 -13.4 0.51 Allowed 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.17 -0.923 . . . . 74.049999999999997 113.345 173.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -109.68 155.55 21.37 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.58 0.229 . . . . 44.219999999999999 110.614 -176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.458 ' HG2' HD13 ' A' ' 53' ' ' ILE . 37.9 mt-10 -87.27 140.09 29.89 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.074 -0.343 . . . . 73.439999999999998 110.074 177.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.1 pt -110.34 179.82 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 64.030000000000001 112.02 -175.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -139.77 161.42 37.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.641 -0.709 . . . . 71.230000000000004 110.234 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.403 ' HG3' ' HD2' ' A' ' 66' ' ' LYS . 33.2 tt0 -66.66 116.9 8.1 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.715 -0.476 . . . . 65.340000000000003 109.715 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.401 ' HA3' ' HD2' ' A' ' 63' ' ' PRO . . . -145.12 -140.33 3.54 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.263 -0.97 . . . . 64.430000000000007 113.26 -173.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.401 ' HD2' ' HA3' ' A' ' 62' ' ' GLY . 30.5 Cg_endo -64.9 -69.82 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 123.12 2.547 . . . . 62.229999999999997 113.586 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 1.007 ' HB3' ' HB2' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -95.61 -8.51 34.69 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.949 -0.3 . . . . 41.329999999999998 110.441 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -94.46 127.66 40.53 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.458 -0.571 . . . . 72.329999999999998 109.458 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.403 ' HD2' ' HG3' ' A' ' 61' ' ' GLU . 18.3 tptm -145.64 115.78 7.45 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.65 -0.5 . . . . 75.239999999999995 109.65 176.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 78' ' ' MET . 4.2 mpp? -119.59 154.02 34.57 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.301 -0.629 . . . . 72.409999999999997 109.301 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.11 138.88 21.9 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.92 0.391 . . . . 75.219999999999999 111.304 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.3 tt -129.86 91.49 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 122.214 1.007 . . . . 73.150000000000006 109.669 171.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -95.72 88.56 5.02 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.211 -1.033 . . . . 74.140000000000001 108.211 177.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.815 ' HD3' ' H ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -92.22 84.33 5.21 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.144 -0.935 . . . . 62.210000000000001 112.23 -167.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -87.56 -51.52 5.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.646 -0.872 . . . . 64.420000000000002 108.646 169.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.4 m -109.3 -64.58 1.23 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.147 -0.933 . . . . 70.230000000000004 108.959 172.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 176.95 90.75 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.687 -0.688 . . . . 61.420000000000002 111.556 175.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.6 mm -135.84 132.46 50.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.57 0.224 . . . . 63.329999999999998 110.526 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 66.5 mt -131.62 124.19 53.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 109.489 -0.56 . . . . 72.329999999999998 109.489 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.426 ' OE1' ' HB3' ' A' ' 9' ' ' ALA . 56.8 mt-10 -132.74 158.52 42.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.421 0.629 . . . . 51.329999999999998 112.249 -175.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.426 ' HG3' ' HG3' ' A' ' 67' ' ' MET . 61.0 ttp -140.97 132.93 27.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 109.172 173.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -128.51 124.22 35.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.174 -0.21 . . . . 64.519999999999996 110.878 -174.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 54.8 mtt -147.86 168.11 23.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.081 0.467 . . . . 54.420000000000002 110.875 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.62 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 7.4 pt-20 -137.95 -55.92 0.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.642 -0.708 . . . . 73.329999999999998 109.218 163.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.602 ' N ' ' HG3' ' A' ' 81' ' ' GLU . 17.9 pttp 167.43 160.96 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.531 0.732 . . . . 52.039999999999999 109.477 -178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 1.007 ' HB2' ' HB3' ' A' ' 64' ' ' LYS . 0.9 OUTLIER -137.0 -71.59 0.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.335 -1.357 . . . . 64.049999999999997 107.335 173.772 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -106.55 171.02 7.58 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 107.812 -1.181 . . . . 65.319999999999993 107.812 167.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -78.14 -21.13 50.78 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.456 -0.498 . . . . 71.340000000000003 110.376 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -76.74 -6.17 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 70.239999999999995 111.147 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.499 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 19.3 m-20 -85.9 -4.62 59.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 54.310000000000002 111.254 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -101.0 150.93 22.38 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.232 -0.44 . . . . 73.030000000000001 109.888 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.492 ' HA2' HG23 ' A' ' 109' ' ' ILE . . . 174.59 -146.34 8.49 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.09 -1.052 . . . . 60.399999999999999 113.381 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.7 m -92.35 110.66 22.06 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.896 0.379 . . . . 51.130000000000003 111.466 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.8 m-85 -90.42 135.29 33.78 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.014 -0.736 . . . . 64.120000000000005 109.014 174.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.783 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 29.2 m -142.68 104.3 4.34 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 120.842 0.354 . . . . 73.129999999999995 110.531 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -93.72 109.44 21.1 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 120.462 -0.495 . . . . 71.319999999999993 109.858 -179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -97.82 117.17 31.52 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.852 -0.613 . . . . 74.329999999999998 109.972 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.8 mt -109.75 120.85 61.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.509 -0.769 . . . . 75.099999999999994 110.835 -174.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HB3' ' A' ' 48' ' ' ALA . 36.8 tt0 -110.28 111.17 22.31 Favored 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 108.723 -0.843 . . . . 73.409999999999997 108.723 173.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 3.2 t70 -109.1 -59.15 1.93 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.248 0.547 . . . . 75.530000000000001 110.691 -176.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.96 -39.55 1.58 Allowed Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.585 -0.734 . . . . 33.450000000000003 111.276 -177.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -101.52 -31.74 10.73 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.056 -0.72 . . . . 63.520000000000003 109.056 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.32 138.48 54.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.1 -0.955 . . . . 63.200000000000003 110.35 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.1 p -139.19 145.64 39.56 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.138 -0.483 . . . . 62.509999999999998 110.356 178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 170.17 -173.33 44.18 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.35 -0.928 . . . . 44.030000000000001 112.358 178.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -138.93 132.19 29.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.995 0.426 . . . . 73.040000000000006 110.645 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.7 m -98.21 97.63 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.498 -0.556 . . . . 73.519999999999996 109.498 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 m -101.42 118.54 37.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.378 -0.373 . . . . 64.040000000000006 110.647 -177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -136.77 115.52 12.13 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 108.735 -0.839 . . . . 70.209999999999994 108.735 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.7 p -107.92 130.43 60.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 120.996 0.427 . . . . 75.319999999999993 111.633 -174.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 96.3 mt -128.49 104.3 7.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.444 . . . . 75.200000000000003 110.329 177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.492 HG23 ' HA2' ' A' ' 89' ' ' GLY . 0.8 OUTLIER -156.52 149.9 10.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.22 -0.445 . . . . 72.340000000000003 110.446 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.51 -125.39 21.8 Favored Glycine 0 CA--C 1.518 0.22 0 O-C-N 123.735 0.647 . . . . 63.039999999999999 113.709 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 36.0 t70 -75.29 -22.96 57.36 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.1 0.476 . . . . 34.200000000000003 111.021 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 45.8 t -62.23 -40.26 87.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.125 -0.489 . . . . 73.400000000000006 111.737 -175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -70.34 -18.7 63.08 Favored 'General case' 0 CA--C 1.528 0.131 0 N-CA-C 112.454 0.539 . . . . 64.209999999999994 112.454 -172.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -77.39 -25.82 51.2 Favored 'General case' 0 C--O 1.226 -0.179 0 C-N-CA 120.343 -0.543 . . . . 71.120000000000005 109.977 179.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.9 tttp -68.67 -55.21 12.19 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.066 -0.516 . . . . 74.140000000000001 110.696 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -62.2 -32.14 72.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.226 0.536 . . . . 71.420000000000002 110.701 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.467 ' HG2' ' HA ' ' A' ' 31' ' ' GLU . 7.5 tt0 -72.82 -49.04 32.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.506 -0.77 . . . . 73.319999999999993 111.352 -176.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -72.42 -27.37 62.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.589 -0.278 . . . . 63.409999999999997 111.712 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -78.05 -10.77 59.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.008 0.432 . . . . 71.230000000000004 110.862 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -93.82 -58.16 2.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.142 -0.481 . . . . 60.130000000000003 110.408 177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' A' ' 30' ' ' LEU . 23.6 mt-10 -129.45 144.88 51.43 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.841 -0.429 . . . . 73.150000000000006 109.841 174.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 22.9 t80 . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.481 -0.771 . . . . 62.409999999999997 110.13 -176.5 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.72 0.295 . . . . 74.109999999999999 110.3 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 1.9 pm0 -77.12 162.52 27.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.167 0.508 . . . . 74.510000000000005 111.007 179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.433 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -71.3 123.11 21.54 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.51 -0.768 . . . . 74.420000000000002 110.71 -174.875 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 54.1 ttm -79.5 -37.56 36.43 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.593 0.59 . . . . 75.329999999999998 112.593 -177.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.433 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 73.4 mmtt -61.71 -26.69 68.2 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.16 0.43 . . . . 62.43 112.16 -170.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -55.09 -23.11 18.89 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.022 0.379 . . . . 74.25 112.022 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 7' ' ' LEU . 3.7 mm? -75.88 -26.84 57.42 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.867 0.365 . . . . 53.420000000000002 110.5 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.2 mt -88.77 -34.86 16.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.111 -0.495 . . . . 75.409999999999997 110.303 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.55 -22.55 58.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 51.329999999999998 111.451 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.85 113.06 1.07 Allowed 'General case' 0 C--O 1.236 0.375 0 O-C-N 123.549 0.53 . . . . 70.310000000000002 111.198 -177.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.563 ' HA ' ' NH2' ' A' ' 36' ' ' ARG . 20.2 m -118.08 177.97 4.6 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 111.967 -174.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -115.12 139.32 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.646 -0.706 . . . . 63.009999999999998 109.132 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HG3' ' NE2' ' A' ' 40' ' ' GLN . 0.5 OUTLIER -84.13 87.46 7.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.605 0.717 . . . . 72.340000000000003 111.663 -175.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -113.32 99.87 8.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.64 -0.709 . . . . 70.120000000000005 109.617 174.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 38.3 mttp -87.5 138.64 31.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.187 -0.46 . . . . 72.430000000000007 110.39 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.72 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 67.4 m-85 -79.06 -53.22 1.13 Allowed Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.188 -0.301 . . . . 63.140000000000001 110.188 175.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 66.6 Cg_endo -91.29 165.21 3.64 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 122.2 1.933 . . . . 72.439999999999998 111.858 173.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -95.87 156.16 16.45 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.822 0.344 . . . . 53.439999999999998 110.417 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG22 ' H ' ' A' ' 21' ' ' THR . 7.8 p -138.99 140.31 26.39 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 109.929 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -54.35 -36.0 85.8 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.763 2.308 . . . . 75.430000000000007 112.728 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.506 ' H ' HG22 ' A' ' 19' ' ' VAL . 22.9 p -102.67 -119.66 0.19 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.365 -0.38 . . . . 61.520000000000003 110.867 178.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.2 mmtp -134.53 -8.58 2.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.777 0.323 . . . . 63.149999999999999 110.579 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.0 t -99.63 111.07 23.45 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 62.409999999999997 112.134 -167.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.75 134.59 25.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 107.261 -1.385 . . . . 64.310000000000002 107.261 167.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.598 ' HB3' ' CB ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -91.49 109.26 20.55 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.139 0.495 . . . . 71.439999999999998 110.276 -170.581 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.53 139.98 43.86 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.629 -0.714 . . . . 62.310000000000002 110.389 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.1 t -129.28 129.48 67.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.162 -0.472 . . . . 53.409999999999997 110.257 -178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 45.7 mt-10 -110.25 119.4 39.12 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.398 -0.594 . . . . 51.009999999999998 109.398 175.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 117' ' ' GLN . 3.7 mp -101.78 121.85 53.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 109.609 -0.515 . . . . 63.219999999999999 109.609 -179.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' ' HG3' ' A' ' 121' ' ' GLU . 6.8 mp -98.47 121.21 40.13 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.508 -0.553 . . . . 72.319999999999993 109.508 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' H ' ' HB3' ' A' ' 121' ' ' GLU . 0.2 OUTLIER -73.21 -11.25 60.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.067 -0.515 . . . . 72.25 110.858 -175.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 43.8 mttp -96.02 8.79 42.77 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.64 -0.709 . . . . 64.120000000000005 111.6 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' O ' ' HE2' ' A' ' 82' ' ' LYS . . . 161.29 -77.59 0.17 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 119.003 -1.57 . . . . 72.319999999999993 115.379 174.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.485 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 9.4 mm100 -100.66 171.72 7.53 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.181 0.515 . . . . 73.510000000000005 112.188 -162.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.66 133.36 68.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.311 -0.625 . . . . 65.200000000000003 109.311 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.563 ' NH2' ' HA ' ' A' ' 11' ' ' SER . 51.1 ttt180 -102.87 120.0 39.83 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.07 -0.514 . . . . 65.349999999999994 110.649 -173.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.595 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.2 t80 -116.32 122.97 46.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.891 -0.595 . . . . 75.549999999999997 109.88 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -150.99 151.38 31.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.953 0.406 . . . . 72.129999999999995 111.347 177.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.514 ' HB3' HD22 ' A' ' 25' ' ' LEU . 19.2 ptm -151.47 155.48 38.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.735 -0.666 . . . . 74.209999999999994 110.329 176.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.539 ' NE2' ' HG3' ' A' ' 13' ' ' GLU . 34.4 tt0 -105.18 125.83 51.41 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.305 -0.407 . . . . 74.409999999999997 110.21 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -132.87 107.22 8.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.908 0.385 . . . . 73.319999999999993 110.861 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.31 -31.37 72.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.045 -0.525 . . . . 62.520000000000003 110.696 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 49.1 mmtm -102.17 119.44 38.8 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.786 -0.643 . . . . 73.209999999999994 109.528 178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -109.85 19.56 18.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.123 0.487 . . . . 70.439999999999998 111.182 -177.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.3 t -87.67 160.47 18.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.848 -0.615 . . . . 62.030000000000001 109.461 176.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -65.22 -8.71 18.69 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.788 0.292 . . . . 62.210000000000001 111.788 -178.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -68.65 -38.03 80.13 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.65 -0.5 . . . . 65.349999999999994 109.65 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -78.8 88.28 4.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.485 -0.932 . . . . 73.420000000000002 108.485 173.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.463 ' CG ' ' HB3' ' A' ' 96' ' ' GLN . 6.4 ptpp? -77.69 111.08 13.1 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.318 -0.855 . . . . 63.43 111.552 -170.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.53 ' HA ' HG13 ' A' ' 95' ' ' ILE . 55.1 t -106.1 104.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.14 -0.936 . . . . 73.409999999999997 109.062 174.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.1 m -99.56 118.31 35.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.804 0.335 . . . . 74.409999999999997 111.386 -175.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.549 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.2 m-85 -76.68 88.8 3.35 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.243 -0.651 . . . . 75.109999999999999 109.243 175.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.608 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.1 mm -113.44 120.49 63.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.413 0.625 . . . . 71.319999999999993 111.586 -175.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -119.48 111.67 18.41 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.506 -0.77 . . . . 73.430000000000007 109.576 175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 53.12 51.18 16.2 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.212 0.53 . . . . 62.109999999999999 110.653 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 69.14 5.14 4.92 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 115.342 -0.845 . . . . 74.409999999999997 112.245 177.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -112.17 132.67 54.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.747 0.308 . . . . 75.109999999999999 110.806 -177.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -72.45 131.67 42.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.006 -0.738 . . . . 63.450000000000003 109.006 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 19.6 pt -108.25 157.59 8.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.416 0.627 . . . . 71.549999999999997 112.418 -171.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -112.96 161.32 17.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.997 -1.001 . . . . 73.420000000000002 110.031 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.481 ' HG3' ' HA ' ' A' ' 66' ' ' LYS . 38.4 tt0 -82.65 146.0 29.34 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.781 0.324 . . . . 62.43 110.414 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -177.76 -145.32 5.84 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 121.027 -0.606 . . . . 64.439999999999998 112.121 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -73.82 -20.83 19.43 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.949 2.433 . . . . 64.129999999999995 112.519 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HE2' ' HB3' ' A' ' 87' ' ' ASP . 5.1 tmtm? -100.87 -29.89 11.98 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.044 -0.525 . . . . 64.329999999999998 110.18 -178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 64' ' ' LYS . 39.3 m-85 -122.68 130.58 53.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.176 -0.465 . . . . 73.150000000000006 110.653 -175.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.481 ' HA ' ' HG3' ' A' ' 61' ' ' GLU . 50.1 tptt -139.74 117.13 11.33 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.097 -0.705 . . . . 41.520000000000003 109.097 172.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.11 159.03 37.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.812 -0.355 . . . . 63.439999999999998 111.739 -171.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 15.5 m-70 -133.92 115.2 14.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.484 . . . . 64.310000000000002 111.509 177.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 3.8 tp -100.43 93.88 3.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 108.474 -0.935 . . . . 73.239999999999995 108.474 168.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -111.91 138.0 49.13 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.389 -0.823 . . . . 75.299999999999997 110.718 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 71' ' ' ARG . 2.3 mpt_? -102.96 0.17 31.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.386 -0.37 . . . . 74.219999999999999 111.042 -176.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -97.82 -21.51 16.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.708 0.289 . . . . 65.409999999999997 111.237 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -108.42 -43.03 4.42 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.761 0.315 . . . . 71.430000000000007 111.779 -175.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.12 1.02 76.5 Favored Glycine 0 N--CA 1.45 -0.38 0 N-CA-C 111.134 -0.786 . . . . 61.509999999999998 111.134 -175.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mm -113.71 114.07 45.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.332 -0.618 . . . . 72.420000000000002 109.332 178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.488 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 72.2 mt -91.93 114.04 28.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 N-CA-C 109.636 -0.505 . . . . 64.430000000000007 109.636 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -121.66 148.44 44.57 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 72.129999999999995 110.442 -174.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.442 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 27.1 ttt -139.3 135.49 33.87 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.003 -0.544 . . . . 63.420000000000002 109.755 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -113.24 125.43 54.3 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.453 -0.573 . . . . 71.049999999999997 109.453 -177.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 84.2 mtp -141.73 172.33 12.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.65 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.485 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.6 pt-20 -160.28 -169.44 2.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.112 -0.949 . . . . 75.340000000000003 109.749 176.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER -89.58 159.13 17.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.747 0.308 . . . . 53.030000000000001 111.07 -174.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.463 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 47.2 tp -140.39 -85.86 0.21 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 75.25 110.205 172.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.463 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 81.6 mt-30 -127.95 -170.63 2.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.552 0.215 . . . . 64.540000000000006 110.906 179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.25 -44.17 97.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.248 -0.433 . . . . 54.409999999999997 111.798 -173.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -75.88 -17.82 59.65 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.156 -0.475 . . . . 64.310000000000002 111.896 -174.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.51 ' HB3' ' HE2' ' A' ' 64' ' ' LYS . 19.0 m-20 -79.4 -33.55 42.62 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.72 0.295 . . . . 73.329999999999998 111.189 -176.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' OE1' ' HA ' ' A' ' 82' ' ' LYS . 0.1 OUTLIER -93.03 114.71 27.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.265 -0.425 . . . . 73.430000000000007 110.254 177.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -163.54 -139.03 2.54 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.403 -0.903 . . . . 74.519999999999996 112.993 -177.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.467 HG23 ' HB ' ' A' ' 107' ' ' VAL . 4.3 m -93.66 108.37 20.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.016 0.436 . . . . 74.329999999999998 111.593 -175.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -91.23 127.64 36.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.148 -0.478 . . . . 72.439999999999998 109.882 176.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.608 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 46.8 m -131.56 105.02 7.28 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.071 0.462 . . . . 61.109999999999999 110.567 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 22.2 m-85 -108.39 106.77 17.04 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.142 -0.481 . . . . 74.310000000000002 110.175 -179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -98.69 115.63 29.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.333 -0.618 . . . . 74.040000000000006 109.333 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.53 HG13 ' HA ' ' A' ' 50' ' ' VAL . 3.5 mp -113.26 125.12 70.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.984 -0.553 . . . . 51.329999999999998 109.675 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.582 ' HA ' HG22 ' A' ' 101' ' ' THR . 36.4 tt0 -108.7 104.27 13.52 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.64 -0.874 . . . . 52.130000000000003 108.64 173.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -107.86 12.74 26.93 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.673 -0.694 . . . . 73.349999999999994 111.281 -171.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 145.14 -123.67 1.97 Allowed Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 120.864 -0.684 . . . . 63.509999999999998 111.89 176.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -74.36 -39.37 62.81 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.399 -0.593 . . . . 74.349999999999994 109.399 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.61 167.33 12.29 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.543 -0.753 . . . . 52.509999999999998 109.769 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 96' ' ' GLN . 30.4 p -138.74 114.13 9.64 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.727 0.298 . . . . 72.329999999999998 111.091 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.413 ' O ' ' HB ' ' A' ' 95' ' ' ILE . . . -80.04 76.1 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.655 -0.784 . . . . 72.140000000000001 111.975 175.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 23.6 p80 -105.35 134.6 48.18 Favored 'General case' 0 C--N 1.326 -0.416 0 O-C-N 122.716 -0.285 . . . . 64.409999999999997 110.492 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.598 ' CB ' ' HB3' ' A' ' 25' ' ' LEU . 15.1 t -136.61 152.53 50.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.116 0.484 . . . . 74.120000000000005 110.627 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 m -130.02 119.53 23.28 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.844 -0.616 . . . . 65.420000000000002 109.467 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.85 113.35 12.15 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.631 -0.507 . . . . 74.510000000000005 109.631 -176.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.562 HG13 HG11 ' A' ' 112' ' ' VAL . 5.4 p -103.71 128.32 57.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 116.173 -0.467 . . . . 72.430000000000007 110.674 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.4 mt -120.48 101.94 8.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.369 -0.378 . . . . 64.430000000000007 110.084 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 44.5 mt -150.62 127.38 2.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.948 -0.39 . . . . 63.119999999999997 109.948 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.423 ' O ' ' HG2' ' A' ' 114' ' ' LYS . . . 47.99 -115.34 2.28 Favored Glycine 0 CA--C 1.518 0.258 0 O-C-N 123.666 0.604 . . . . 71.299999999999997 114.327 173.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 4.9 p-10 -69.65 -23.88 63.54 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.603 -0.299 . . . . 73.010000000000005 111.35 -176.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.562 HG11 HG13 ' A' ' 107' ' ' VAL . 36.1 t -71.34 -48.2 55.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.529 -0.305 . . . . 71.200000000000003 110.711 -177.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -70.1 -37.24 75.35 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 120.231 -0.587 . . . . 73.019999999999996 111.207 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 110' ' ' GLY . 6.8 ptmt -63.98 -34.3 77.68 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.179 -0.208 . . . . 74.329999999999998 111.525 -177.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -67.44 -55.44 13.64 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.716 -0.394 . . . . 72.319999999999993 109.974 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 74.6 mt -64.73 -34.69 78.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.788 -0.642 . . . . 64.340000000000003 111.085 -177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.53 ' HA ' ' HB ' ' A' ' 29' ' ' ILE . 36.2 tt0 -63.61 -55.0 27.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.686 -0.688 . . . . 65.230000000000004 111.646 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -76.58 -21.28 55.82 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.394 -0.366 . . . . 75.409999999999997 111.56 -172.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -76.88 -11.37 59.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 110.115 174.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -103.67 -56.85 2.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 33.32 110.881 178.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.478 ' HG3' ' HA ' ' A' ' 30' ' ' LEU . 1.2 tm-20 -107.54 113.16 26.3 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.818 -0.438 . . . . 61.450000000000003 109.818 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.907 -0.568 . . . . 55.420000000000002 110.905 -175.508 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 110.206 -0.294 . . . . 64.239999999999995 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -73.5 135.31 44.03 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 109.449 -0.575 . . . . 64.430000000000007 109.449 175.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.616 ' HG2' ' H ' ' A' ' 5' ' ' LYS . 6.9 tt0 -80.51 118.73 22.37 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.569 -0.741 . . . . 72.120000000000005 111.838 -172.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -77.62 -12.56 59.98 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.233 -0.439 . . . . 54.539999999999999 112.031 177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.616 ' H ' ' HG2' ' A' ' 3' ' ' GLU . 47.8 mmtm -58.65 -51.06 71.54 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.846 0.355 . . . . 62.140000000000001 111.202 -176.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -68.98 -15.49 63.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.119 -0.491 . . . . 71.099999999999994 111.828 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -74.65 -30.92 61.79 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.069 0.461 . . . . 72.299999999999997 109.79 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.05 -13.32 61.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.745 -0.661 . . . . 74.519999999999996 111.074 -178.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.26 -29.64 69.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.505 -0.316 . . . . 72.230000000000004 111.517 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.415 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.2 mp -82.99 137.22 34.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.427 -0.351 . . . . 64.5 110.826 -177.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -158.79 -56.72 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.29 -0.414 . . . . 63.229999999999997 111.15 176.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -146.15 172.36 13.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.867 0.365 . . . . 74.319999999999993 111.114 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' ' OE1' ' A' ' 40' ' ' GLN . 1.3 pm0 -90.25 -168.75 2.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.501 -0.772 . . . . 72.019999999999996 110.267 175.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -73.19 81.45 1.31 Allowed 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 122.078 0.942 . . . . 73.010000000000005 110.937 -178.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -90.62 -44.96 9.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.595 -0.729 . . . . 62.100000000000001 110.251 176.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 88.8 t80 -71.23 -53.11 8.4 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.651 -0.704 . . . . 74.120000000000005 111.796 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 3.5 Cg_exo -76.65 112.72 3.51 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.147 1.898 . . . . 54.130000000000003 112.044 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -88.53 142.68 27.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.316 -0.402 . . . . 70.530000000000001 109.943 177.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 21' ' ' THR . 3.4 p -163.37 140.51 5.79 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.163 -0.471 . . . . 63.439999999999998 109.748 -174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -50.18 -50.88 12.16 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.869 2.379 . . . . 73.439999999999998 112.417 177.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.471 ' O ' HG13 ' A' ' 19' ' ' VAL . 1.2 p -86.61 -159.22 0.47 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.093 -0.503 . . . . 54.340000000000003 109.844 174.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 42' ' ' GLU . 33.5 mmtm -109.8 -2.31 17.38 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.653 -0.654 . . . . 74.040000000000006 110.385 178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -98.91 107.23 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.262 0.553 . . . . 63.310000000000002 111.338 -171.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -157.81 155.41 29.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.116 -0.947 . . . . 65.099999999999994 108.771 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.828 ' HG ' ' HB2' ' A' ' 104' ' ' SER . 0.5 OUTLIER -94.41 131.42 40.1 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.982 0.42 . . . . 72.530000000000001 110.541 -174.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.493 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -122.16 122.95 40.38 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.072 -0.513 . . . . 61.329999999999998 110.378 176.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 9.1 p -121.19 138.19 52.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.251 -0.431 . . . . 52.409999999999997 110.512 -178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.584 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 57.0 tt0 -125.14 129.26 49.82 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.433 -0.58 . . . . 72.109999999999999 109.433 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 53.2 mt -100.0 114.82 39.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.493 -0.321 . . . . 74.439999999999998 111.257 -174.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 3.4 mm? -100.17 102.78 14.17 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.02 -0.733 . . . . 74.129999999999995 109.02 171.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.631 ' OE2' ' HG2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -62.97 -12.06 23.08 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.612 -0.722 . . . . 72.239999999999995 112.608 -173.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.631 ' HG2' ' OE2' ' A' ' 31' ' ' GLU . 1.9 pttm -82.06 11.87 4.76 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 111.773 0.286 . . . . 74.439999999999998 111.773 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 130.14 -36.86 2.24 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 119.898 -1.144 . . . . 74.430000000000007 114.288 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 9.4 mm100 -93.35 139.22 30.91 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 117.095 0.448 . . . . 62.530000000000001 111.301 -172.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.8 p -108.53 128.93 63.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 N-CA-C 109.486 -0.561 . . . . 63.030000000000001 109.486 173.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 39.4 ttt180 -101.11 110.53 22.57 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.991 -0.55 . . . . 64.019999999999996 110.55 -174.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 37.2 t80 -118.0 123.43 45.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.942 -0.572 . . . . 74.540000000000006 109.799 -179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.427 ' HA ' ' HA ' ' A' ' 77' ' ' GLU . 45.4 p-90 -150.3 143.66 25.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.073 0.464 . . . . 71.409999999999997 111.41 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.505 ' HB3' HD22 ' A' ' 25' ' ' LEU . 16.8 ptm -132.7 157.15 45.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.964 -0.562 . . . . 72.310000000000002 110.085 176.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.474 ' OE1' ' HB2' ' A' ' 13' ' ' GLU . 50.2 tt0 -135.13 140.76 45.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.101 -0.5 . . . . 74.400000000000006 110.786 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -130.3 156.29 44.9 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.726 -0.842 . . . . 72.25 108.726 169.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.601 ' HB3' ' HG3' ' A' ' 22' ' ' LYS . 6.4 pt-20 -69.55 -33.83 73.33 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.899 0.38 . . . . 64.310000000000002 110.733 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.478 ' HD3' ' O ' ' A' ' 42' ' ' GLU . 71.2 mmtt -130.28 176.98 7.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.644 -0.873 . . . . 73.239999999999995 108.644 177.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.462 ' H ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -106.86 -20.91 13.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.402 0.62 . . . . 54.240000000000002 109.381 175.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.0 t -114.93 111.35 21.02 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.644 -0.707 . . . . 53.119999999999997 109.715 174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 25.2 p -166.92 -88.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.937 0.399 . . . . 72.200000000000003 110.998 177.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -136.7 2.02 2.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.044 -0.525 . . . . 74.230000000000004 109.745 179.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.65 101.06 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.549 -0.751 . . . . 74.010000000000005 112.416 -171.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 27.5 mmmt -108.96 111.15 22.67 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.688 -0.687 . . . . 62.399999999999999 109.172 171.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.6 t -103.48 104.61 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.815 0.341 . . . . 70.109999999999999 110.631 -176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 27.1 m -88.91 109.87 20.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.191 -0.459 . . . . 64.310000000000002 110.283 178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.512 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 43.1 m-85 -81.27 87.8 6.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.1 -0.5 . . . . 61.32 109.734 179.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.686 ' HB ' ' O ' ' A' ' 92' ' ' THR . 48.7 mm -109.29 124.82 66.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.511 0.672 . . . . 62.240000000000002 112.155 -174.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -122.96 114.42 20.4 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 73.099999999999994 109.281 171.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 54.07 47.39 23.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 75.129999999999995 110.184 -179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 71.52 8.14 6.16 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.307 -0.86 . . . . 65.120000000000005 112.611 176.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -118.65 142.82 47.29 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 121.217 -0.193 . . . . 71.450000000000003 110.51 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -77.43 125.21 28.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.776 0.322 . . . . 71.349999999999994 110.261 178.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 25.0 pt -109.71 159.07 9.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 71.150000000000006 111.548 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -132.66 161.16 34.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.487 -0.778 . . . . 74.120000000000005 109.193 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -55.58 129.39 38.82 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 123.309 0.38 . . . . 72.310000000000002 110.431 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.408 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -162.05 -121.59 0.58 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.641 -0.79 . . . . 61.310000000000002 112.933 -174.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.408 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 11.5 Cg_exo -70.49 -62.98 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 123.111 2.541 . . . . 50.340000000000003 113.133 -173.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.451 ' HE3' ' HB3' ' A' ' 87' ' ' ASP . 2.4 ptpt -103.03 9.75 38.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.695 0.284 . . . . 73.329999999999998 110.814 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -111.68 130.08 55.89 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.348 -0.387 . . . . 64.409999999999997 110.59 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -141.55 117.3 10.4 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.434 -0.58 . . . . 70.340000000000003 109.434 171.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -111.07 159.42 17.81 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.08 0.467 . . . . 72.510000000000005 111.162 -175.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -110.43 123.23 49.5 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.887 -0.782 . . . . 75.430000000000007 108.887 168.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 13.8 tt -112.54 95.46 3.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.913 0.864 . . . . 72.540000000000006 110.268 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -95.31 135.13 37.3 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.325 -0.852 . . . . 71.510000000000005 111.482 -177.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.25 -4.16 14.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.852 -0.613 . . . . 64.129999999999995 110.106 176.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.7 m-80 -81.7 -52.57 7.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.91 0.386 . . . . 43.25 110.651 -173.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.2 m -109.34 -56.53 2.28 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.068 0.461 . . . . 65.340000000000003 110.31 -177.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 128.34 39.96 0.32 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.476 -0.784 . . . . 60.530000000000001 111.157 -174.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.6 mm -110.85 135.7 49.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 109.757 -0.46 . . . . 54.439999999999998 109.757 -178.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.88 108.83 10.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.876 0.369 . . . . 72.019999999999996 110.585 178.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 38' ' ' TRP . 0.6 OUTLIER -110.57 154.0 24.35 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.63 -0.507 . . . . 61.140000000000001 109.63 173.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 60.2 ttp -139.15 124.53 19.22 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.32 -0.622 . . . . 72.430000000000007 109.32 177.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -110.58 114.53 28.01 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.94 -0.393 . . . . 75.230000000000004 109.94 -176.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 48.4 mtm -131.88 177.95 7.15 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.083 0.468 . . . . 72.099999999999994 110.766 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -150.72 -169.49 3.4 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.372 -0.831 . . . . 71.310000000000002 109.152 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -88.75 153.6 20.96 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.081 -0.34 . . . . 70.310000000000002 110.081 178.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.12 -76.59 0.51 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.558 -0.534 . . . . 72.239999999999995 109.558 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.529 ' HG3' ' H ' ' A' ' 85' ' ' ASP . 17.9 tp60 -162.23 176.59 10.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.701 -0.851 . . . . 65.310000000000002 108.701 179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.529 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 2.7 m-20 -59.23 -13.78 8.76 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 122.767 0.427 . . . . 62.340000000000003 111.969 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.47 ' HG2' ' HB3' ' A' ' 84' ' ' GLN . 10.8 pt-20 -72.81 -39.54 66.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.304 -0.407 . . . . 63.32 111.38 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.451 ' HB3' ' HE3' ' A' ' 64' ' ' LYS . 3.4 m-20 -108.44 -14.7 14.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.519 0.2 . . . . 44.340000000000003 111.362 -177.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.75 102.64 8.21 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.332 0.587 . . . . 63.119999999999997 109.953 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -156.9 -154.21 6.96 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.239 -0.891 . . . . 54.439999999999998 111.667 -177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.7 m -93.22 108.21 19.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.058 0.456 . . . . 71.310000000000002 111.292 -178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -86.39 140.16 30.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.426 -0.583 . . . . 73.219999999999999 109.426 174.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.686 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 90.3 m -143.34 104.94 4.32 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.175 0.512 . . . . 75.010000000000005 110.724 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.512 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 25.3 m-85 -106.7 116.47 31.98 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.833 -0.622 . . . . 73.450000000000003 109.95 179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -114.73 127.18 55.6 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.046 -0.525 . . . . 73.209999999999994 110.295 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.467 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 4.5 mp -114.33 123.25 69.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.518 -0.764 . . . . 64.540000000000006 109.989 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.547 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 53.9 tt0 -76.58 133.87 39.55 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.933 -0.576 . . . . 74.140000000000001 110.313 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.614 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 8.7 t70 -137.95 -70.59 0.43 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.245 -0.434 . . . . 73.409999999999997 110.712 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 143.55 -58.23 0.54 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.596 -0.811 . . . . 72.439999999999998 112.492 177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -78.17 -29.18 48.47 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.829 0.824 . . . . 55.109999999999999 108.863 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.614 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -143.87 170.07 16.59 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 114.382 -1.281 . . . . 73.109999999999999 108.481 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 61.2 m -127.89 113.72 16.27 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 120.751 -0.38 . . . . 64.0 110.012 174.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.43 122.71 30.79 Favored Glycine 0 N--CA 1.448 -0.524 0 N-CA-C 111.056 -0.818 . . . . 72.299999999999997 111.056 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -137.37 132.92 34.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.014 0.435 . . . . 72.450000000000003 111.368 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.828 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 48.2 t -136.09 98.61 3.91 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.786 -0.643 . . . . 64.409999999999997 110.7 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 57.7 m -98.54 117.12 32.26 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.603 -0.888 . . . . 74.409999999999997 108.603 171.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 2.2 tm? -138.62 108.28 6.24 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.112 -0.699 . . . . 74.409999999999997 109.112 -175.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.0 p -109.74 118.04 55.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.241 0.544 . . . . 61.439999999999998 111.197 -176.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.56 ' HA ' ' HB3' ' A' ' 113' ' ' TYR . 87.5 mt -115.45 103.25 10.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.111 -0.495 . . . . 64.120000000000005 109.704 176.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 63.3 mt -147.43 127.5 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.828 -0.169 . . . . 74.030000000000001 110.767 -178.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 50.2 -126.04 22.07 Favored Glycine 0 CA--C 1.519 0.298 0 O-C-N 123.745 0.653 . . . . 62.109999999999999 113.991 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -74.69 -23.89 58.69 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 75.430000000000007 110.836 -178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 54.2 t -63.28 -42.28 95.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.772 -0.649 . . . . 72.150000000000006 111.333 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.56 ' HB3' ' HA ' ' A' ' 108' ' ' LEU . 1.2 p90 -64.63 -30.95 71.98 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 120.128 -0.629 . . . . 64.150000000000006 112.385 -176.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 13.1 pttm -90.89 -12.15 37.02 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.138 -0.625 . . . . 74.129999999999995 110.591 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -60.98 -46.93 88.77 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.215 -0.661 . . . . 75.040000000000006 109.215 176.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 7.7 mp -70.79 -32.97 70.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 71.230000000000004 110.523 175.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.55 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 73.9 mt-30 -60.7 -34.77 74.86 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.01 -0.541 . . . . 64.219999999999999 111.871 -178.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 10.3 mtpm? -51.11 -46.66 61.96 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.091 0.472 . . . . 75.209999999999994 111.687 176.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -90.75 -10.31 43.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.736 -0.666 . . . . 74.519999999999996 111.731 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -66.29 -80.41 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.722 0.638 . . . . 61.329999999999998 112.722 -171.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -143.6 68.31 1.28 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.354 0.597 . . . . 72.040000000000006 109.591 -175.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 68.2 t80 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 118.495 -0.764 . . . . 74.209999999999994 110.298 -176.032 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.114 0 N-CA-C 109.895 -0.409 . . . . 72.439999999999998 109.895 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -108.34 68.85 0.71 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.186 -0.461 . . . . 74.319999999999993 109.89 178.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -56.85 136.96 55.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.737 -0.665 . . . . 72.319999999999993 110.122 178.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -64.55 -21.61 66.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.688 0.28 . . . . 70.219999999999999 111.058 -174.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -61.51 -34.9 76.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.073 0.463 . . . . 73.540000000000006 110.456 174.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.6 ttm105 -79.26 -25.62 42.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.791 -0.641 . . . . 64.530000000000001 110.661 -177.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.27 -26.9 64.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.156 -0.475 . . . . 54.229999999999997 110.237 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.3 mm? -89.61 -13.9 36.15 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.891 -0.595 . . . . 74.310000000000002 110.396 174.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' ' CD ' ' A' ' 36' ' ' ARG . . . -79.45 -42.79 24.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.101 176.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.558 HD21 ' HG2' ' A' ' 77' ' ' GLU . 89.4 mt -75.03 106.95 6.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.669 -0.696 . . . . 65.239999999999995 110.698 177.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.4 t -98.57 -177.85 3.81 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.469 . . . . 73.319999999999993 109.732 177.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -79.47 158.87 27.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.461 -0.336 . . . . 72.109999999999999 110.192 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.04 103.71 11.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.435 -0.58 . . . . 74.439999999999998 109.435 176.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -153.87 48.08 0.64 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.703 -0.851 . . . . 74.030000000000001 108.703 175.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.9 tppp? -79.71 140.97 36.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.183 -0.917 . . . . 73.409999999999997 110.932 -174.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.607 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 85.6 m-85 -102.25 -48.3 0.18 Allowed Pre-proline 0 CA--C 1.538 0.481 0 CA-C-N 116.025 -0.534 . . . . 55.009999999999998 112.173 177.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.607 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 60.6 Cg_endo -72.72 45.77 0.93 Allowed 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.432 2.088 . . . . 51.009999999999998 113.235 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 p -88.68 179.61 6.21 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.001 -0.545 . . . . 73.400000000000006 110.62 177.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.787 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 19.1 m -97.64 -175.99 0.48 Allowed Pre-proline 0 C--N 1.321 -0.669 0 N-CA-C 108.866 -0.79 . . . . 75.340000000000003 108.866 177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.787 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 85.9 Cg_exo -50.79 -25.54 15.66 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.245 1.963 . . . . 70.519999999999996 113.189 175.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.455 ' H ' HG23 ' A' ' 19' ' ' VAL . 2.0 p -106.8 -178.01 3.53 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.263 -0.426 . . . . 73.140000000000001 111.087 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.8 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 14.3 mmmm -108.5 21.36 17.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.146 0.498 . . . . 62.509999999999998 109.682 -178.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.4 m -96.91 88.55 4.58 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.644 -0.707 . . . . 64.340000000000003 109.774 -175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -114.35 132.89 56.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.767 -0.652 . . . . 70.219999999999999 111.233 -176.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.579 HD22 ' HB3' ' A' ' 39' ' ' MET . 1.4 tm? -97.25 112.12 24.06 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.481 -0.933 . . . . 71.129999999999995 108.481 173.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -112.37 130.73 55.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.267 0.556 . . . . 63.130000000000003 111.914 -175.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 51.5 t -117.7 119.2 60.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.675 -0.693 . . . . 63.509999999999998 109.611 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.473 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.8 146.44 38.83 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.364 -0.38 . . . . 75.510000000000005 110.353 -178.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 50.3 mt -122.9 129.64 74.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.053 0.454 . . . . 45.219999999999999 112.022 -172.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.603 ' HB2' ' HB3' ' A' ' 34' ' ' GLN . 84.4 mt -115.98 127.59 55.06 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.501 -0.926 . . . . 71.530000000000001 108.501 169.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -81.47 1.54 32.84 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.892 -0.323 . . . . 55.240000000000002 111.837 -168.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -84.37 5.01 28.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.925 0.393 . . . . 65.25 111.038 174.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.466 ' HA2' ' HG3' ' A' ' 82' ' ' LYS . . . 100.93 40.38 2.89 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.623 -0.799 . . . . 74.340000000000003 112.371 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.603 ' HB3' ' HB2' ' A' ' 30' ' ' LEU . 60.8 tp60 -137.25 134.56 36.32 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 73.450000000000003 110.527 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.591 ' HB ' ' HB3' ' A' ' 80' ' ' MET . 52.5 t -115.16 115.96 51.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.269 -0.641 . . . . 72.129999999999995 109.269 175.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.483 ' CD ' ' HA ' ' A' ' 9' ' ' ALA . 46.2 ttp180 -97.24 110.88 23.34 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.202 -0.454 . . . . 75.120000000000005 109.997 -176.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.553 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 57.1 t80 -114.43 120.32 39.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.004 -0.544 . . . . 64.349999999999994 110.639 -175.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.7 p-90 -150.77 142.07 23.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.085 -0.507 . . . . 52.539999999999999 109.838 177.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.579 ' HB3' HD22 ' A' ' 25' ' ' LEU . 12.7 ptm -130.85 143.2 50.56 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.125 0.488 . . . . 71.030000000000001 110.678 177.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -98.77 143.65 28.88 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.654 -0.703 . . . . 73.439999999999998 110.403 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -137.54 144.04 41.92 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.955 -0.566 . . . . 73.319999999999993 109.92 174.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.8 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -90.42 -29.14 18.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.699 -0.682 . . . . 73.0 109.62 178.628 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.588 ' HG3' ' HG2' ' A' ' 42' ' ' GLU . 24.0 mtmt -100.72 145.74 28.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.342 -0.845 . . . . 41.409999999999997 110.577 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 pp -110.02 -0.06 18.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.406 0.622 . . . . 63.200000000000003 110.317 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.6 p -85.31 145.79 27.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.553 -0.749 . . . . 65.049999999999997 110.338 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 m -76.39 49.19 0.57 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.071 0.462 . . . . 64.219999999999999 111.478 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -87.19 -42.78 12.72 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.355 -0.609 . . . . 64.540000000000006 109.355 175.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -91.83 107.84 19.5 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.528 -0.76 . . . . 71.200000000000003 109.957 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -82.56 122.15 27.71 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.17 0.509 . . . . 72.040000000000006 111.234 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.423 HG13 HG12 ' A' ' 95' ' ' ILE . 46.1 t -103.76 108.9 25.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.497 -0.774 . . . . 73.430000000000007 109.86 177.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.1 m -97.63 131.43 44.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.42 -0.355 . . . . 62.340000000000003 110.659 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.542 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 58.0 m-85 -82.2 94.66 7.33 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.17 -0.678 . . . . 75.25 109.17 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.646 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.3 mm -110.17 135.85 47.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.327 0.584 . . . . 74.340000000000003 111.081 -173.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -133.8 110.9 10.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.617 -0.72 . . . . 62.039999999999999 109.084 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 55.51 43.38 28.6 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 121.364 0.602 . . . . 74.5 110.245 -177.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 71.07 3.73 4.78 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.17 -0.923 . . . . 75.549999999999997 112.395 177.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -108.81 161.46 15.1 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.3 -0.63 . . . . 73.439999999999998 109.3 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -97.07 150.6 20.64 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.006 -0.368 . . . . 73.010000000000005 110.006 174.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 pt -111.66 164.8 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.264 0.554 . . . . 65.109999999999999 112.088 -169.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -118.39 156.32 29.18 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.641 -0.709 . . . . 72.150000000000006 109.471 178.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' CD ' ' HD2' ' A' ' 66' ' ' LYS . 29.1 tt0 -80.19 140.38 36.34 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.172 -0.307 . . . . 65.329999999999998 110.172 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -174.7 -145.46 5.32 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.714 -0.755 . . . . 70.140000000000001 112.382 -175.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.17 -20.48 21.44 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.678 2.252 . . . . 75.329999999999998 113.394 -176.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.812 ' HE2' ' HB2' ' A' ' 83' ' ' LEU . 32.4 tttm -108.68 -15.59 14.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.958 0.409 . . . . 73.140000000000001 110.297 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.481 ' CD1' ' HE2' ' A' ' 80' ' ' MET . 16.8 m-85 -125.68 128.93 48.58 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.12 -0.491 . . . . 73.109999999999999 111.029 -170.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 78' ' ' MET . 43.3 tptt -144.64 115.55 7.83 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.881 -0.785 . . . . 72.219999999999999 108.881 170.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.1 mpp? -111.68 143.64 42.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.819 0.342 . . . . 72.299999999999997 111.064 -173.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -130.96 116.52 17.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.913 -0.585 . . . . 73.25 110.284 176.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.5 tp -104.04 105.23 18.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.491 0.662 . . . . 60.420000000000002 110.188 177.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -87.59 141.5 28.56 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.012 -0.54 . . . . 70.230000000000004 110.791 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 71' ' ' ARG . 0.1 OUTLIER -125.6 4.81 7.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.598 -0.728 . . . . 62.399999999999999 109.493 178.271 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -94.89 -42.42 8.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.836 -0.62 . . . . 64.340000000000003 111.136 -173.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 p -118.81 -36.27 3.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.943 0.401 . . . . 75.120000000000005 111.543 -178.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.75 9.84 25.92 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.918 -0.658 . . . . 55.25 111.851 -177.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.7 mm -95.39 104.14 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.179 0.514 . . . . 64.010000000000005 109.895 177.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.545 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 61.7 mt -103.46 122.7 56.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.782 -0.645 . . . . 64.400000000000006 110.138 -177.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.558 ' HG2' HD21 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -131.97 160.49 35.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.275 0.559 . . . . 75.430000000000007 110.578 179.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.553 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 22.3 ttt -144.0 148.05 34.74 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.354 -0.839 . . . . 52.149999999999999 109.042 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -108.67 113.72 26.92 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.141 0.496 . . . . 62.200000000000003 109.82 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.591 ' HB3' ' HB ' ' A' ' 35' ' ' VAL . 1.1 mmt -115.9 137.08 52.44 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.399 -0.819 . . . . 72.219999999999999 110.658 -178.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -127.24 -176.54 3.76 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.262 -0.426 . . . . 61.229999999999997 110.128 174.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.466 ' HG3' ' HA2' ' A' ' 33' ' ' GLY . 8.3 mmmm -88.39 143.37 27.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.298 0.57 . . . . 73.010000000000005 112.3 -172.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.812 ' HB2' ' HE2' ' A' ' 64' ' ' LYS . 0.2 OUTLIER -134.23 -159.88 1.0 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.23 -1.026 . . . . 61.299999999999997 108.23 172.592 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -96.81 179.34 5.0 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.09 -0.244 . . . . 55.039999999999999 111.012 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -54.16 -23.29 13.73 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 113.235 0.828 . . . . 63.210000000000001 113.235 -173.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.3 -45.42 66.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.901 0.382 . . . . 74.319999999999993 110.796 -179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -95.95 -22.68 17.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.129 -0.487 . . . . 74.200000000000003 111.175 -175.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -86.61 115.33 24.01 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.792 -0.818 . . . . 74.329999999999998 108.792 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.461 ' HA2' ' CG1' ' A' ' 109' ' ' ILE . . . -162.64 -134.66 1.68 Allowed Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 119.952 -1.118 . . . . 42.219999999999999 113.463 -175.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 6.0 m -86.28 107.3 17.89 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.066 0.46 . . . . 32.020000000000003 112.151 -174.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -83.18 117.68 23.08 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.227 -0.657 . . . . 71.030000000000001 109.227 173.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.689 ' HA ' ' O ' ' A' ' 104' ' ' SER . 50.4 m -144.83 103.17 3.88 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.785 -0.366 . . . . 55.229999999999997 110.913 177.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.542 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 15.6 m-85 -96.57 145.44 25.72 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.933 -0.395 . . . . 73.010000000000005 109.933 177.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -128.75 119.82 25.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.095 0.474 . . . . 70.019999999999996 110.712 -176.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 25' ' ' LEU . 42.9 mt -120.63 136.29 58.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.408 -0.815 . . . . 45.399999999999999 110.279 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -97.65 109.68 22.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.907 0.384 . . . . 72.030000000000001 110.63 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.504 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 16.9 t70 -109.15 166.08 11.12 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.33 -0.618 . . . . 75.340000000000003 109.33 175.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -72.33 -19.6 78.85 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.826 -0.702 . . . . 73.510000000000005 112.575 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -110.98 -56.13 2.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.991 0.424 . . . . 73.109999999999999 111.159 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.504 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -113.69 157.04 22.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.101 -0.5 . . . . 54.030000000000001 111.615 -173.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 5.8 p -98.42 113.35 25.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.115 -0.698 . . . . 73.540000000000006 109.115 171.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.6 83.49 1.43 Allowed Glycine 0 N--CA 1.444 -0.802 0 C-N-CA 120.884 -0.674 . . . . 72.209999999999994 112.784 -172.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.415 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 10.8 p-80 -102.78 134.74 45.68 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.276 -0.639 . . . . 73.099999999999994 109.276 173.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.689 ' O ' ' HA ' ' A' ' 92' ' ' THR . 23.7 t -130.36 100.45 5.37 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.233 -0.655 . . . . 73.409999999999997 109.233 176.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 61.8 m -101.68 118.15 36.34 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.119 0.485 . . . . 74.450000000000003 110.59 -178.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.0 OUTLIER -145.49 111.32 5.52 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.936 -0.765 . . . . 50.229999999999997 108.936 177.508 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 7.0 p -96.55 125.52 49.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-O 121.241 0.543 . . . . 71.439999999999998 111.441 -176.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.424 HD22 ' HB2' ' A' ' 113' ' ' TYR . 87.6 mt -120.21 103.28 9.12 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.949 -0.569 . . . . 74.310000000000002 110.297 178.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.461 ' CG1' ' HA2' ' A' ' 89' ' ' GLY . 60.3 mt -145.56 126.75 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 116.84 -0.163 . . . . 71.329999999999998 110.614 179.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 47.57 -117.98 3.8 Favored Glycine 0 CA--C 1.52 0.404 0 O-C-N 123.402 0.439 . . . . 53.350000000000001 113.863 174.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.661 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 20.4 t70 -72.63 -23.1 60.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.14 0.495 . . . . 75.519999999999996 110.961 -177.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.03 -48.36 88.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.309 -0.405 . . . . 72.109999999999999 110.676 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.424 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.3 p90 -69.18 -23.28 63.9 Favored 'General case' 0 C--N 1.334 -0.095 0 C-N-CA 120.255 -0.578 . . . . 73.030000000000001 112.437 -175.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.661 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -71.41 -25.28 62.27 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 120.497 -0.481 . . . . 54.310000000000002 109.725 -178.57 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -66.78 -40.86 88.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.019 -0.537 . . . . 72.129999999999995 109.676 176.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.401 ' HG ' HD11 ' A' ' 106' ' ' LEU . 3.8 mm? -70.47 -44.67 67.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.503 -0.771 . . . . 64.549999999999997 110.497 177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.53 -35.21 80.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.478 . . . . 62.130000000000003 111.732 -178.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -45.07 92.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.08 0.467 . . . . 73.329999999999998 109.977 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -83.22 -15.04 51.96 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.967 -0.56 . . . . 73.230000000000004 110.67 -177.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -76.22 -57.19 4.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.149 -0.478 . . . . 70.420000000000002 110.704 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -124.64 137.41 54.37 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.993 0.425 . . . . 73.430000000000007 110.87 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.709 -0.662 . . . . 72.420000000000002 109.771 178.833 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.363 -0.606 . . . . 75.129999999999995 109.363 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -111.05 132.26 54.38 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.325 -0.398 . . . . 73.540000000000006 111.055 -173.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -78.27 102.78 7.82 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 107.833 -1.173 . . . . 72.430000000000007 107.833 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 35.2 ttm -67.91 -32.09 72.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.423 -0.808 . . . . 72.299999999999997 112.815 -162.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -21.31 63.73 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.692 -0.403 . . . . 73.409999999999997 110.799 -177.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 79' ' ' PHE . 22.2 mmt85 -80.82 -9.1 59.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.132 -0.486 . . . . 50.520000000000003 110.352 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.0 tt -88.64 -23.88 22.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.941 -0.572 . . . . 72.310000000000002 111.415 -173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.5 8.71 1.67 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 111.899 0.333 . . . . 65.209999999999994 111.899 -175.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' HB2' ' HD1' ' A' ' 79' ' ' PHE . . . -79.59 -26.82 41.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.75 0.31 . . . . 74.200000000000003 110.99 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.6 tp -57.52 129.04 40.04 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.85 -0.614 . . . . 72.519999999999996 111.267 -177.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -142.36 173.47 11.5 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 61.200000000000003 110.199 -178.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -80.21 144.71 32.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.527 -0.306 . . . . 71.129999999999995 110.323 176.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 13' ' ' GLU . 0.8 OUTLIER -73.7 118.53 16.76 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.715 -0.476 . . . . 62.509999999999998 109.715 178.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -156.37 29.62 0.34 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.844 0.354 . . . . 73.430000000000007 111.521 -175.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 24' ' ' GLU . 74.8 mmtt -81.11 97.17 7.43 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.653 -0.499 . . . . 72.400000000000006 109.653 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.625 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 98.2 m-85 -60.49 -53.29 66.02 Favored Pre-proline 0 CA--C 1.535 0.388 0 CA-C-N 116.108 -0.497 . . . . 73.209999999999994 111.407 -179.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 71.6 Cg_endo -83.59 111.11 1.73 Allowed 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 121.736 1.624 . . . . 65.319999999999993 111.834 174.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -163.74 -169.81 2.01 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.827 -0.434 . . . . 65.420000000000002 109.827 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.1 m -77.41 160.17 75.84 Favored Pre-proline 0 C--N 1.328 -0.368 0 N-CA-C 110.593 -0.151 . . . . 70.019999999999996 110.593 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -63.19 -16.03 51.89 Favored 'Trans proline' 0 N--CA 1.476 0.496 0 C-N-CA 123.358 2.705 . . . . 75.150000000000006 114.054 -176.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.3 p -84.67 -173.06 4.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.659 0.266 . . . . 65.439999999999998 110.894 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -86.8 4.33 41.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.876 0.369 . . . . 64.340000000000003 111.116 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.3 t -88.13 115.27 25.5 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.104 -0.498 . . . . 73.239999999999995 110.754 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 15' ' ' LYS . 10.5 pt-20 -116.29 133.62 55.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.524 -0.547 . . . . 70.099999999999994 109.524 169.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 95' ' ' ILE . 3.3 tm? -101.7 126.85 48.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.592 -0.731 . . . . 72.230000000000004 109.326 -178.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -121.27 118.42 29.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.066 0.46 . . . . 63.130000000000003 111.565 -178.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' CD1' ' A' ' 25' ' ' LEU . 58.0 t -120.88 97.94 5.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 108.589 -0.893 . . . . 71.209999999999994 108.589 171.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 5.2 mm-40 -95.6 112.99 24.59 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.289 -0.634 . . . . 72.299999999999997 109.289 -176.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.9 mp -91.89 111.97 24.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.347 -0.388 . . . . 72.319999999999993 110.197 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.0 117.49 33.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.269 -0.423 . . . . 44.229999999999997 110.301 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.459 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 26.7 tt0 -63.1 -16.71 60.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.547 0.689 . . . . 62.43 109.731 176.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -73.62 13.48 0.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.232 -0.894 . . . . 75.430000000000007 111.79 -179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 120.05 -31.36 5.34 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.613 -0.803 . . . . 63.329999999999998 114.652 167.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.42 ' NE2' ' HB3' ' A' ' 81' ' ' GLU . 12.1 mm100 -113.26 143.26 44.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.337 0.568 . . . . 74.340000000000003 111.984 -169.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.1 t -107.69 114.61 46.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 108.931 -0.766 . . . . 73.549999999999997 108.931 171.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.595 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 16.0 ttm180 -95.57 103.63 15.5 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.255 -0.429 . . . . 73.329999999999998 110.873 -174.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.429 ' CE2' HD21 ' A' ' 25' ' ' LEU . 42.8 t80 -106.26 126.94 52.84 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.976 -0.557 . . . . 71.099999999999994 109.728 175.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 57.4 p-90 -153.04 144.19 23.09 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.078 0.466 . . . . 71.439999999999998 110.613 171.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.427 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 10.1 ptm -130.73 151.08 51.57 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.811 -0.631 . . . . 72.409999999999997 110.951 -177.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -119.96 156.0 31.7 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.835 -0.621 . . . . 72.140000000000001 110.085 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -134.75 164.62 27.14 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.565 -0.531 . . . . 61.420000000000002 109.565 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 3.3 pt-20 -82.58 -22.78 34.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.03 0.443 . . . . 75.239999999999995 110.492 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.7 mttp -118.24 122.44 42.96 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.532 -0.544 . . . . 75.519999999999996 109.532 176.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 ' CA ' ' A' ' 74' ' ' GLY . 23.9 mt -84.43 73.77 10.46 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.943 0.401 . . . . 64.310000000000002 110.694 -174.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.43 ' HA ' ' OD1' ' A' ' 70' ' ' ASP . 8.7 t -178.08 -173.35 0.37 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.678 -0.86 . . . . 60.509999999999998 108.678 179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.8 m -77.2 67.03 3.09 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.231 0.538 . . . . 51.039999999999999 111.068 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -112.37 -47.71 3.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.856 -0.611 . . . . 64.25 109.944 176.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.86 116.88 7.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.597 -0.729 . . . . 65.439999999999998 110.639 178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 96' ' ' GLN . 31.0 mmmt -80.29 102.77 9.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.076 -0.511 . . . . 73.200000000000003 110.197 178.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 94' ' ' GLN . 41.7 t -115.1 113.02 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.879 -0.601 . . . . 74.5 110.097 -178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.2 m -80.71 111.44 17.15 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.129 -0.487 . . . . 62.130000000000003 109.912 175.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -79.42 83.89 5.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.779 -0.452 . . . . 72.319999999999993 109.779 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.591 ' HB ' ' O ' ' A' ' 92' ' ' THR . 71.7 mt -105.95 115.52 47.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.575 -0.738 . . . . 70.209999999999994 111.294 -175.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 59' ' ' ILE . 70.5 t80 -111.07 102.08 10.57 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.429 -0.805 . . . . 64.310000000000002 109.574 175.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 54.35 47.58 22.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.294 0.569 . . . . 62.310000000000002 110.087 -178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 70.5 9.4 6.91 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.051 -0.977 . . . . 72.319999999999993 111.928 177.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -107.23 131.06 54.59 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.836 -0.431 . . . . 75.510000000000005 109.836 176.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -76.33 113.85 14.35 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.661 -0.496 . . . . 75.140000000000001 109.661 174.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.537 HD13 ' HB2' ' A' ' 54' ' ' PHE . 14.4 pt -97.4 166.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-O 121.702 0.763 . . . . 54.43 112.617 -174.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -130.06 -177.83 4.47 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.506 -1.225 . . . . 71.409999999999997 108.392 175.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 36.8 tt0 -77.92 127.83 32.98 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.122 0.487 . . . . 71.439999999999998 110.789 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -137.28 -155.84 7.08 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.706 -0.679 . . . . 64.219999999999999 111.787 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.76 -40.2 13.39 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.62 2.213 . . . . 73.040000000000006 111.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.564 ' HD2' ' OD2' ' A' ' 87' ' ' ASP . 69.6 tttt -88.61 -51.32 5.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.769 -0.651 . . . . 74.340000000000003 110.605 178.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.408 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 1.3 m-85 -80.74 83.48 6.49 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.58 -0.736 . . . . 74.530000000000001 109.9 -175.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.646 ' O ' ' HA ' ' A' ' 78' ' ' MET . 24.0 tptp -103.05 114.64 29.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 71.530000000000001 109.837 178.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 67.0 mtm -102.76 155.99 17.94 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.995 0.426 . . . . 73.099999999999994 110.721 -175.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 67.5 m170 -116.17 135.43 53.92 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.995 -0.743 . . . . 74.049999999999997 108.995 173.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.9 tp -71.15 140.98 17.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.084 0.468 . . . . 75.409999999999997 110.694 -177.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.43 ' OD1' ' HA ' ' A' ' 45' ' ' SER . 2.1 p30 -55.6 -26.14 42.35 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.267 -0.879 . . . . 52.350000000000001 113.084 -174.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -76.95 35.96 0.17 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.786 0.661 . . . . 74.010000000000005 112.786 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -121.87 -74.21 0.62 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.993 0.425 . . . . 62.030000000000001 110.731 175.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 p -109.03 -9.59 15.07 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.029 -0.532 . . . . 71.109999999999999 111.104 -176.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.576 ' CA ' HD22 ' A' ' 44' ' ' LEU . . . 90.67 -0.07 76.44 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 110.899 -0.88 . . . . 73.299999999999997 110.899 -172.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 40.9 mm -110.3 148.53 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-N 114.717 -0.741 . . . . 72.530000000000001 109.071 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.427 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.9 mt -115.76 90.72 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.125 -0.694 . . . . 70.310000000000002 109.125 172.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.94 137.54 32.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.099 0.476 . . . . 64.430000000000007 110.567 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 50.7 ttp -124.51 98.71 5.85 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.584 -0.734 . . . . 74.239999999999995 109.037 173.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.463 ' HD2' ' HD3' ' A' ' 6' ' ' ARG . 15.4 t80 -83.81 112.64 20.29 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.436 -0.802 . . . . 72.549999999999997 109.999 -174.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 62.0 mtm -123.72 158.31 31.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.215 0.531 . . . . 74.5 111.839 -172.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.486 ' H ' ' HG3' ' A' ' 64' ' ' LYS . 10.9 pt-20 -150.29 144.28 25.46 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.221 -0.899 . . . . 71.510000000000005 108.791 171.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 82' ' ' LYS . 0.0 OUTLIER -53.83 117.33 3.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.124 0.488 . . . . 61.25 110.699 178.131 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.498 ' HG ' ' OE1' ' A' ' 84' ' ' GLN . 19.1 tp -115.74 -55.98 2.38 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.273 -0.421 . . . . 63.439999999999998 110.648 -177.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.875 ' HB2' ' HB2' ' A' ' 87' ' ' ASP . 2.7 mp0 -101.44 -174.8 2.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.037 -0.357 . . . . 71.109999999999999 110.037 176.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -83.62 -54.22 5.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.938 0.399 . . . . 63.5 110.582 179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -81.98 5.16 20.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.623 0.725 . . . . 74.530000000000001 109.735 178.966 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.875 ' HB2' ' HB2' ' A' ' 84' ' ' GLN . 12.1 t70 -75.83 -15.94 60.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.847 -1.069 . . . . 72.219999999999999 110.806 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -103.34 132.03 49.94 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.863 -0.791 . . . . 73.340000000000003 108.863 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.605 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -159.98 -157.33 8.57 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.293 -0.956 . . . . 74.230000000000004 113.201 -174.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 15.0 m -91.18 106.88 18.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.796 0.331 . . . . 72.299999999999997 110.836 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.3 m-85 -81.4 110.28 16.67 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.846 -0.427 . . . . 71.230000000000004 109.846 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.591 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 14.0 m -122.23 98.65 6.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.198 0.523 . . . . 74.329999999999998 110.407 -177.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 91' ' ' TYR . 94.6 m-85 -115.2 118.33 33.01 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.067 -0.515 . . . . 73.329999999999998 110.269 -177.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 103' ' ' HIS . 28.0 pt20 -101.36 113.03 25.74 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.589 -0.523 . . . . 71.409999999999997 109.589 174.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 25' ' ' LEU . 53.5 mt -96.41 104.12 15.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.999 -0.546 . . . . 74.540000000000006 110.627 -179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.703 ' HB3' ' HB2' ' A' ' 49' ' ' LYS . 35.6 tt0 -86.73 82.93 7.69 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.555 -0.535 . . . . 73.010000000000005 109.555 174.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -110.01 114.59 28.23 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.37 -0.832 . . . . 64.510000000000005 110.383 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 75.79 -74.55 1.56 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.929 -0.653 . . . . 64.439999999999998 112.613 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -145.08 -64.93 0.33 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.702 0.287 . . . . 74.519999999999996 110.605 -176.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.88 146.53 52.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.095 -0.502 . . . . 64.230000000000004 110.974 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.9 p -104.9 107.05 17.81 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.143 -0.481 . . . . 72.239999999999995 111.09 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.59 95.18 0.98 Allowed Glycine 0 N--CA 1.445 -0.718 0 N-CA-C 111.098 -0.801 . . . . 22.43 111.098 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.489 ' HA ' ' HA ' ' A' ' 94' ' ' GLN . 10.2 p80 -105.66 106.12 16.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.456 0.646 . . . . 75.450000000000003 110.715 -176.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.481 ' O ' ' HA ' ' A' ' 92' ' ' THR . 45.9 t -98.75 138.75 35.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.639 -0.71 . . . . 72.150000000000006 110.189 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.2 m -125.95 94.87 4.23 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.855 -0.611 . . . . 63.219999999999999 109.386 176.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.417 ' HG ' HG11 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -107.33 100.57 10.01 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.661 -0.7 . . . . 61.32 109.348 -177.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.553 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -89.1 114.99 28.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 121.265 0.555 . . . . 73.450000000000003 111.383 -177.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -120.61 81.69 1.8 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 60.140000000000001 110.287 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.605 HG12 ' HA2' ' A' ' 89' ' ' GLY . 14.9 mt -139.05 135.39 42.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 121.104 -0.238 . . . . 71.219999999999999 111.096 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 57.42 -115.94 7.35 Favored Glycine 0 C--N 1.329 0.161 0 O-C-N 123.326 0.392 . . . . 72.150000000000006 113.648 172.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -88.52 -2.46 58.61 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.268 0.556 . . . . 71.400000000000006 110.266 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 25.8 t -86.59 -37.88 11.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 116.041 -0.527 . . . . 73.409999999999997 110.773 -179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.631 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.3 p90 -66.04 -27.08 67.83 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 120.373 -0.531 . . . . 73.219999999999999 111.143 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -81.4 -21.67 38.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.896 0.379 . . . . 73.349999999999994 110.615 178.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.424 ' HG2' ' OE2' ' A' ' 119' ' ' GLU . 52.5 tttm -65.79 -61.99 1.75 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.845 -0.616 . . . . 61.130000000000003 110.066 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 116' ' ' LEU . 6.3 mp -70.76 -13.88 62.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.16 -0.473 . . . . 61.130000000000003 110.699 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.631 ' HB2' ' O ' ' A' ' 113' ' ' TYR . 6.0 tp-100 -62.53 -55.61 25.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.671 -0.695 . . . . 75.420000000000002 110.073 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 121' ' ' GLU . 20.5 mtpp -91.53 0.08 57.54 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.679 -0.691 . . . . 75.040000000000006 111.398 -175.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.424 ' OE2' ' HG2' ' A' ' 115' ' ' LYS . 40.0 mt-10 -69.28 -19.13 63.9 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.247 -0.649 . . . . 62.119999999999997 109.247 168.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -110.2 -61.85 1.6 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.311 -0.859 . . . . 75.230000000000004 110.059 174.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 118' ' ' LYS . 69.7 mm-40 -95.78 97.73 9.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.98 0.419 . . . . 60.43 111.105 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 10.1 p90 . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.353 -0.832 . . . . 74.420000000000002 109.841 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.778 0.323 . . . . 72.340000000000003 110.497 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.403 ' HG3' ' HD3' ' A' ' 6' ' ' ARG . 43.8 tt0 -106.57 90.25 3.28 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.118 0.485 . . . . 74.049999999999997 110.051 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.422 ' OE2' ' HB3' ' A' ' 5' ' ' LYS . 9.4 pt-20 -77.1 155.39 32.45 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.933 -0.576 . . . . 63.350000000000001 109.699 175.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.8 ttt -61.28 -26.98 68.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.882 0.372 . . . . 74.140000000000001 110.469 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 8' ' ' LEU . 51.1 tttt -71.19 -11.72 61.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.073 -0.512 . . . . 74.310000000000002 110.944 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.403 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 57.5 ttt180 -71.58 -49.57 39.22 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.124 -0.695 . . . . 74.409999999999997 109.124 172.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' HD12 ' A' ' 7' ' ' LEU . 4.1 mp -75.1 -30.27 60.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.571 -0.74 . . . . 64.219999999999999 109.994 -178.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' A' ' 5' ' ' LYS . 56.0 tp -69.48 -27.57 65.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.477 -0.783 . . . . 63.219999999999999 110.993 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.52 40.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.44 -0.346 . . . . 72.25 111.337 -177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 0.9 OUTLIER -48.56 112.74 0.64 Allowed 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.899 0.749 . . . . 75.310000000000002 112.13 -176.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.468 ' HB2' ' HD2' ' A' ' 36' ' ' ARG . 23.4 t -97.04 -171.61 2.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.269 -0.878 . . . . 61.549999999999997 110.253 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.78 110.55 23.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 63.43 109.879 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -81.59 5.53 17.8 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.982 -0.554 . . . . 64.140000000000001 111.41 -175.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -78.06 87.23 4.2 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.17 0.51 . . . . 71.409999999999997 111.273 -176.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.562 ' HB2' HG23 ' A' ' 18' ' ' THR . 8.5 mmmm -97.78 110.29 22.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.785 -0.643 . . . . 75.329999999999998 109.611 171.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.614 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 58.1 t80 -65.46 -53.03 41.05 Favored Pre-proline 0 C--N 1.323 -0.563 0 C-N-CA 120.969 -0.293 . . . . 74.420000000000002 110.427 178.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 90.8 Cg_endo -82.8 68.2 7.63 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.822 1.681 . . . . 72.109999999999999 111.857 173.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 15' ' ' LYS . 0.0 OUTLIER -84.94 162.67 19.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.798 -0.637 . . . . 74.230000000000004 111.422 -179.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.561 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 20.2 m -83.69 161.01 57.44 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-N 115.802 -0.635 . . . . 75.400000000000006 109.575 172.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.561 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 68.6 Cg_endo -73.3 26.63 0.31 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 122.844 2.362 . . . . 62.119999999999997 113.893 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 100' ' ' ALA . 38.7 m -157.46 144.14 18.08 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.764 -0.828 . . . . 61.0 108.764 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.723 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 75.0 mmtt -78.47 81.21 4.82 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.335 0.588 . . . . 64.030000000000001 110.697 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.8 m -152.89 33.38 0.48 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.296 -0.865 . . . . 74.439999999999998 108.667 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.448 ' HG2' ' HG3' ' A' ' 15' ' ' LYS . 8.0 tp10 -65.39 147.34 53.59 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 114.346 -1.297 . . . . 71.120000000000005 111.094 -177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.5 tm? -136.64 106.97 6.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.016 -0.538 . . . . 73.140000000000001 109.72 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.429 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -128.31 157.96 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.045 -0.525 . . . . 74.409999999999997 110.437 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -145.93 121.53 3.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.263 0.554 . . . . 75.549999999999997 111.034 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 22.8 mm-40 -105.21 140.53 38.22 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.889 -0.782 . . . . 71.040000000000006 108.889 177.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.28 118.06 56.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 C-N-CA 120.529 -0.468 . . . . 72.409999999999997 110.829 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -87.01 130.06 34.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.019 -0.734 . . . . 75.129999999999995 109.019 177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.39 9.11 0.37 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 112.643 0.608 . . . . 63.340000000000003 112.643 -174.939 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -93.13 11.41 27.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.876 0.369 . . . . 73.340000000000003 110.013 178.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 81.3 31.03 35.32 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.912 -0.661 . . . . 64.129999999999995 111.662 -178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -132.83 136.52 46.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 110.014 -0.365 . . . . 73.150000000000006 110.014 -178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.7 p -104.59 137.91 31.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.066 0.46 . . . . 73.140000000000001 110.844 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.561 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 20.1 tpp180 -108.99 94.91 5.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.652 -0.704 . . . . 75.540000000000006 109.38 176.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 59.3 t80 -108.61 134.78 50.88 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.28 -0.418 . . . . 72.549999999999997 110.474 -177.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.429 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 58.8 p-90 -143.68 151.5 40.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 73.319999999999993 111.168 179.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.562 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 14.2 ptp -151.0 135.96 17.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 52.409999999999997 109.765 174.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -113.26 116.42 29.73 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.971 -0.381 . . . . 61.520000000000003 109.971 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.32 124.66 52.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.695 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 6.0 pt-20 -81.65 -11.35 59.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.032 -0.531 . . . . 75.450000000000003 111.29 179.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 63.6 mttp -115.01 101.54 9.1 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.192 -0.458 . . . . 73.319999999999993 110.459 -176.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.604 HD11 ' HA2' ' A' ' 74' ' ' GLY . 3.0 mm? -98.13 -12.76 21.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.157 -0.474 . . . . 72.510000000000005 110.445 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.2 m -150.75 97.53 2.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.098 -0.501 . . . . 72.239999999999995 110.593 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -170.75 -175.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.901 -0.59 . . . . 60.509999999999998 109.878 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -82.71 91.4 7.0 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.941 0.4 . . . . 64.129999999999995 110.172 175.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -166.05 176.43 7.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.47 -0.786 . . . . 70.450000000000003 109.62 -179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -157.14 158.87 37.12 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.055 -0.35 . . . . 74.25 110.055 177.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.3 p -126.99 109.17 20.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.398 0.618 . . . . 54.539999999999999 109.683 174.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 21.6 m -91.8 115.73 28.3 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.926 -0.579 . . . . 74.519999999999996 111.123 -174.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -94.14 91.52 6.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.808 -0.812 . . . . 75.349999999999994 108.808 173.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.487 ' HB ' ' HB ' ' A' ' 92' ' ' THR . 51.7 mm -99.9 111.45 29.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.777 -0.647 . . . . 73.25 111.819 -171.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.435 ' HB3' HG23 ' A' ' 59' ' ' ILE . 68.9 t80 -103.63 102.76 12.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.459 -0.571 . . . . 74.150000000000006 109.459 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 56.48 36.4 27.5 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.166 -0.47 . . . . 71.450000000000003 110.683 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 73.58 19.21 3.37 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.264 -0.88 . . . . 63.310000000000002 111.67 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -115.07 134.57 55.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.993 -0.743 . . . . 71.530000000000001 108.993 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.39 120.63 21.9 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.786 -0.366 . . . . 63.130000000000003 110.15 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.435 HG23 ' HB3' ' A' ' 54' ' ' PHE . 10.2 pt -96.45 166.74 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.072 0.463 . . . . 64.040000000000006 111.626 -178.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -135.69 -177.92 4.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.562 -0.745 . . . . 75.25 109.82 -177.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -66.21 120.62 13.55 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.751 -0.463 . . . . 75.010000000000005 109.751 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -147.72 173.84 27.66 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.757 -0.735 . . . . 71.030000000000001 112.255 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.39 -43.37 56.29 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.769 2.312 . . . . 72.340000000000003 112.046 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.603 ' HG2' ' O ' ' A' ' 81' ' ' GLU . 1.5 tmtp? -80.26 -50.89 9.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.927 -0.579 . . . . 43.450000000000003 109.697 177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.512 ' HE1' ' HE2' ' A' ' 91' ' ' TYR . 63.6 m-85 -86.07 75.54 9.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.756 -0.657 . . . . 74.430000000000007 110.513 -177.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 79' ' ' PHE . 9.5 mmtm -81.45 76.68 8.37 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.388 0.613 . . . . 75.099999999999994 110.687 178.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.403 ' HG2' ' HG3' ' A' ' 78' ' ' MET . 61.4 mtm -95.99 121.96 38.3 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.277 -0.874 . . . . 73.120000000000005 109.182 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -122.62 97.1 5.3 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 120.715 -0.394 . . . . 72.299999999999997 110.722 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . 0.41 ' HA ' HG12 ' A' ' 76' ' ' ILE . 37.5 pt -79.9 130.83 35.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.055 -0.52 . . . . 70.409999999999997 110.18 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -127.82 111.63 13.85 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.105 0.478 . . . . 73.430000000000007 110.636 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -81.09 -5.52 57.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.834 -0.621 . . . . 74.409999999999997 111.461 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -87.38 -23.73 24.46 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.074 0.464 . . . . 72.010000000000005 110.621 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.9 p -118.96 -34.37 3.92 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.143 -0.48 . . . . 73.0 111.398 -178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.604 ' HA2' HD11 ' A' ' 44' ' ' LEU . . . 89.87 3.67 73.41 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 111.064 -0.815 . . . . 42.340000000000003 111.064 -175.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mm -98.89 111.46 28.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 109.594 -0.521 . . . . 74.409999999999997 109.594 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.562 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 68.7 mt -113.21 98.58 7.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.301 -0.409 . . . . 63.420000000000002 110.359 -178.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.441 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 4.2 mm-40 -97.61 144.16 27.56 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.908 -0.587 . . . . 75.010000000000005 110.299 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.518 ' HG2' ' HG3' ' A' ' 80' ' ' MET . 55.3 ttp -123.35 114.69 20.52 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.21 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.468 ' O ' ' HB2' ' A' ' 66' ' ' LYS . 0.9 OUTLIER -108.83 88.78 2.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.197 -0.456 . . . . 75.310000000000002 109.965 -177.157 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.518 ' HG3' ' HG2' ' A' ' 78' ' ' MET . 53.6 mtm -95.11 148.26 22.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.062 0.458 . . . . 75.239999999999995 111.827 -175.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 9.3 pt-20 -139.37 132.14 29.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.17 -0.923 . . . . 75.519999999999996 108.903 173.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 pptp? -63.24 139.39 58.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.985 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.1 tp -114.02 -49.54 2.85 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.319 -0.4 . . . . 63.420000000000002 111.018 179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.466 ' H ' ' CB ' ' A' ' 87' ' ' ASP . 14.0 mm100 -127.91 179.06 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.407 -0.36 . . . . 54.109999999999999 110.562 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -78.23 -32.56 49.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.039 0.447 . . . . 73.150000000000006 110.331 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -89.91 12.13 18.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.711 -0.677 . . . . 72.129999999999995 110.224 177.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.507 ' OD2' ' HG3' ' A' ' 64' ' ' LYS . 18.4 t70 -94.84 -21.67 18.54 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.168 -0.923 . . . . 64.439999999999998 111.02 -174.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -99.59 145.42 27.57 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.497 -0.557 . . . . 73.319999999999993 109.497 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.509 ' HA2' HG13 ' A' ' 109' ' ' ILE . . . -166.76 -154.96 8.66 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.505 -0.855 . . . . 52.200000000000003 112.884 -176.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 18.3 m -93.23 117.63 30.3 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.73 0.3 . . . . 74.200000000000003 110.701 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.512 ' HE2' ' HE1' ' A' ' 65' ' ' TYR . 82.8 m-85 -103.77 104.67 14.71 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.243 -0.435 . . . . 74.109999999999999 110.646 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.487 ' HB ' ' HB ' ' A' ' 53' ' ' ILE . 28.5 m -100.22 113.93 26.98 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.149 -0.478 . . . . 71.430000000000007 110.268 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -101.13 117.98 36.07 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.398 -0.364 . . . . 74.340000000000003 110.508 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 51' ' ' SER . 42.5 tt0 -117.45 105.21 11.88 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.894 -0.594 . . . . 70.109999999999999 110.775 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.427 ' N ' HD12 ' A' ' 95' ' ' ILE . 3.4 mp -93.43 103.18 14.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 108.714 -0.847 . . . . 75.120000000000005 108.714 173.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 50.0 tt0 -86.86 78.78 8.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.055 0.455 . . . . 74.140000000000001 110.588 -176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -90.83 155.61 18.64 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.56 -0.745 . . . . 64.439999999999998 109.247 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.1 -31.73 77.82 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 121.171 -0.538 . . . . 61.210000000000001 112.723 -178.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -116.23 -58.89 2.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.777 0.322 . . . . 71.120000000000005 111.022 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.429 ' HB2' ' HB ' ' A' ' 21' ' ' THR . . . -91.01 81.02 5.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.165 0.507 . . . . 65.420000000000002 111.172 -175.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.5 m -75.29 89.76 2.59 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.905 -0.589 . . . . 74.010000000000005 109.881 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.26 111.9 3.42 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.552 -0.749 . . . . 71.230000000000004 112.003 -177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 9.9 p80 -120.85 137.62 54.47 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.627 -0.508 . . . . 72.349999999999994 109.627 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.5 t -148.46 110.79 4.66 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.87 -0.418 . . . . 73.150000000000006 109.87 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 31.2 m -94.34 102.35 14.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 71.430000000000007 110.214 178.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 54.9 tp -101.06 104.2 15.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.043 -0.526 . . . . 63.340000000000003 110.596 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.1 p -86.74 117.07 30.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.891 -0.595 . . . . 54.039999999999999 110.671 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 113' ' ' TYR . 93.3 mt -132.23 85.75 2.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.893 0.377 . . . . 61.310000000000002 110.804 179.202 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.509 HG13 ' HA2' ' A' ' 89' ' ' GLY . 4.9 mp -126.87 116.39 44.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 109.945 -0.391 . . . . 72.230000000000004 109.945 174.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 55.86 -111.31 2.39 Favored Glycine 0 N--CA 1.452 -0.256 0 O-C-N 123.787 0.679 . . . . 63.100000000000001 113.272 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.687 ' HA ' ' HG2' ' A' ' 114' ' ' LYS . 17.1 t70 -68.09 -27.52 66.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.044 0.45 . . . . 70.510000000000005 110.934 -175.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 18.8 t -72.84 -26.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.397 0.617 . . . . 64.540000000000006 109.825 178.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.531 ' HA ' HD22 ' A' ' 108' ' ' LEU . 7.5 t80 -83.25 -33.68 25.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.654 -0.703 . . . . 65.030000000000001 110.654 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.687 ' HG2' ' HA ' ' A' ' 111' ' ' ASP . 9.9 ptmm? -80.0 -11.77 59.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.909 0.385 . . . . 64.019999999999996 110.665 175.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 54.6 tttp -60.82 -55.23 35.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.914 -0.585 . . . . 73.549999999999997 110.241 174.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.23 -19.99 65.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 74.340000000000003 111.624 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.605 ' CG ' ' HA ' ' A' ' 114' ' ' LYS . 78.5 mm-40 -56.96 -48.91 77.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.034 0.445 . . . . 73.549999999999997 110.696 179.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.58 -15.31 17.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.48 0.548 . . . . 74.219999999999999 112.48 -176.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -97.8 7.4 46.45 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.478 -0.489 . . . . 70.310000000000002 111.384 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -112.33 -59.82 1.95 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.328 -0.619 . . . . 34.0 109.328 169.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -105.81 126.37 52.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.924 -0.58 . . . . 70.25 110.136 173.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.308 -0.853 . . . . 75.430000000000007 110.352 -175.929 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.898 0.38 . . . . 74.219999999999999 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -99.35 148.24 24.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.081 -0.508 . . . . 72.519999999999996 110.275 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -62.67 109.03 1.28 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.222 -0.444 . . . . 72.310000000000002 111.13 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -62.16 -19.16 62.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 63.509999999999998 110.605 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -58.03 -33.41 68.94 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.652 -0.704 . . . . 72.310000000000002 110.526 178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.428 ' HD2' ' O ' ' A' ' 6' ' ' ARG . 1.7 tmm_? -62.35 -37.04 84.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.799 -0.637 . . . . 73.430000000000007 110.251 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.7 mt -71.96 -27.11 62.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.048 0.452 . . . . 72.340000000000003 110.988 -177.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' O ' ' HD3' ' A' ' 36' ' ' ARG . 82.4 mt -89.12 -32.3 17.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.865 -0.607 . . . . 55.350000000000001 111.135 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.61 -31.35 24.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.245 -0.434 . . . . 73.040000000000006 111.664 -177.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.2 tt -62.13 126.15 26.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.284 0.564 . . . . 73.439999999999998 110.843 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.2 m -142.71 146.9 34.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.469 -0.787 . . . . 75.239999999999995 109.002 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -78.75 164.38 24.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.203 0.525 . . . . 74.430000000000007 111.526 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.433 ' HA ' ' CH2' ' A' ' 38' ' ' TRP . 1.2 pm0 -74.34 137.98 43.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.364 -0.835 . . . . 61.409999999999997 112.964 -168.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -139.09 91.31 2.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.796 -1.093 . . . . 65.340000000000003 108.192 168.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.507 ' HA ' ' OE2' ' A' ' 24' ' ' GLU . 22.1 tptm -66.9 118.8 10.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.516 -0.311 . . . . 73.430000000000007 111.052 -172.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.735 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 64.3 m-85 -98.85 -53.91 0.19 Allowed Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.371 -0.377 . . . . 62.25 111.452 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.735 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 2.9 Cg_exo -76.92 123.04 6.57 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.238 1.959 . . . . 53.43 112.187 177.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 29.3 m -76.7 104.66 7.33 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.083 -0.508 . . . . 64.319999999999993 110.12 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.428 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 7.5 p -161.39 134.34 4.57 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.951 -0.568 . . . . 71.400000000000006 110.044 -177.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 29.9 Cg_exo -62.18 96.33 0.15 Allowed 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.979 2.453 . . . . 71.400000000000006 112.606 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 t 172.94 160.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.154 -0.93 . . . . 71.219999999999999 109.283 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 40' ' ' GLN . 70.3 mmtt -108.2 24.81 12.44 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 63.149999999999999 109.766 176.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 41.8 t -98.5 126.56 44.1 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.713 -0.676 . . . . 55.32 109.453 175.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 40' ' ' GLN . 7.3 tp10 -143.01 122.46 13.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.007 -0.542 . . . . 72.150000000000006 110.045 -177.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 1.2 tm? -107.59 108.52 19.84 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.996 -0.372 . . . . 64.329999999999998 109.996 -178.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -120.47 141.33 50.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.93 0.395 . . . . 65.540000000000006 111.09 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.8 t -125.85 118.62 52.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.976 -0.556 . . . . 75.109999999999999 109.913 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.549 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 17.0 mm-40 -109.38 120.82 43.66 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.753 -0.462 . . . . 73.230000000000004 109.753 -178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.458 ' H ' HD12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -105.51 113.01 41.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.342 -0.39 . . . . 53.009999999999998 110.384 -175.702 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -99.14 139.1 35.29 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.32 -0.622 . . . . 71.420000000000002 109.32 179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.818 ' H ' ' HG3' ' A' ' 121' ' ' GLU . 6.7 pt-20 -70.38 -5.75 30.55 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.869 0.322 . . . . 72.349999999999994 111.869 -171.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -82.56 2.82 31.22 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 121.006 -0.278 . . . . 72.349999999999994 111.012 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.72 18.76 43.18 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.8 -0.715 . . . . 72.400000000000006 112.797 175.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.893 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -114.13 119.54 37.46 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.86 0.362 . . . . 65.140000000000001 110.292 179.592 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -93.98 117.1 36.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.211 -0.45 . . . . 73.209999999999994 110.137 178.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.549 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 32.7 ttp180 -97.35 110.83 23.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.261 0.553 . . . . 72.439999999999998 109.997 179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 24.4 t80 -117.37 122.43 43.84 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.455 -0.793 . . . . 70.409999999999997 109.482 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.433 ' CH2' ' HA ' ' A' ' 13' ' ' GLU . 62.7 p-90 -145.1 149.85 35.77 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.264 0.554 . . . . 73.430000000000007 111.502 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.574 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 22.2 ptm -144.05 144.91 31.85 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.361 -0.836 . . . . 73.5 110.171 175.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.543 ' HG2' ' HB3' ' A' ' 24' ' ' GLU . 26.2 pt20 -102.18 147.14 27.0 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.355 -0.384 . . . . 75.439999999999998 110.458 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -138.47 150.55 46.56 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.007 -0.542 . . . . 62.109999999999999 109.67 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 11.9 pt-20 -101.52 14.06 33.1 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.881 0.326 . . . . 74.120000000000005 111.881 -175.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -142.26 147.34 36.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.702 0.286 . . . . 75.540000000000006 111.028 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.4 mt -108.82 -61.13 1.65 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.666 -0.697 . . . . 72.409999999999997 109.825 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.2 t -92.72 139.15 30.86 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 108.458 -0.942 . . . . 71.530000000000001 108.458 173.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t 60.45 42.26 14.75 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 109.003 -0.74 . . . . 74.439999999999998 109.003 -173.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -65.11 172.05 3.26 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.926 -1.034 . . . . 53.039999999999999 111.842 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.73 145.57 55.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.682 -0.69 . . . . 43.119999999999997 110.381 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -80.35 111.45 16.75 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.95 0.405 . . . . 72.209999999999994 110.108 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.594 HG23 HG12 ' A' ' 95' ' ' ILE . 12.5 p -115.3 141.86 30.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.289 -0.414 . . . . 54.450000000000003 110.824 -177.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.9 m -104.29 115.25 30.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 71.340000000000003 110.204 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 36.0 m-85 -77.0 85.05 3.52 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.555 -0.535 . . . . 72.140000000000001 109.555 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 47.9 mm -115.11 128.99 72.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.358 0.599 . . . . 70.239999999999995 112.057 -173.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.492 ' HB3' HG21 ' A' ' 59' ' ' ILE . 71.4 t80 -134.91 121.63 20.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.533 -0.758 . . . . 73.030000000000001 108.956 170.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 56.59 38.37 29.54 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.372 0.605 . . . . 75.219999999999999 110.108 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 65.69 24.35 11.55 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.335 -0.848 . . . . 72.140000000000001 111.566 178.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.3 mmtp -122.58 136.2 54.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.888 -0.596 . . . . 73.319999999999993 109.739 178.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -76.27 120.48 21.59 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.866 -0.791 . . . . 75.230000000000004 108.866 174.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.492 HG21 ' HB3' ' A' ' 54' ' ' PHE . 26.8 pt -108.31 -178.04 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 112.508 0.559 . . . . 74.230000000000004 112.508 -168.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -153.35 161.08 42.7 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.038 -0.983 . . . . 74.150000000000006 109.785 -177.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.431 ' HA ' ' HB2' ' A' ' 65' ' ' TYR . 44.7 tt0 -70.29 145.28 51.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 71.299999999999997 110.49 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 163.33 -95.66 0.13 Allowed Glycine 0 CA--C 1.521 0.429 0 C-N-CA 120.143 -1.027 . . . . 72.209999999999994 113.516 -178.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -61.43 -75.96 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.946 2.431 . . . . 73.140000000000001 113.635 -172.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.569 ' HE3' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -108.57 15.76 23.52 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.07 0.462 . . . . 71.140000000000001 110.516 -178.965 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.431 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 75.6 m-85 -113.64 129.49 56.56 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.943 -0.572 . . . . 72.150000000000006 111.26 -176.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 78' ' ' MET . 0.2 OUTLIER -137.94 114.78 10.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.589 -1.263 . . . . 73.109999999999999 107.589 170.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.421 ' HB2' ' HE3' ' A' ' 78' ' ' MET . 14.4 tmm? -132.36 153.25 50.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.896 0.379 . . . . 74.299999999999997 111.479 -169.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -120.03 129.38 54.22 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.043 -0.526 . . . . 73.219999999999999 109.702 177.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 25.7 pt -82.3 145.02 9.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 CA-C-O 121.55 0.69 . . . . 62.210000000000001 112.251 -173.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -81.77 91.53 6.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.177 -0.92 . . . . 53.32 111.319 -178.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 71' ' ' ARG . 5.3 mtp180 -137.35 -40.39 0.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.165 -0.471 . . . . 72.530000000000001 110.463 175.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -98.82 -29.64 12.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.273 -0.421 . . . . 63.200000000000003 112.082 -177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.1 p -108.19 -57.75 2.08 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.839 0.352 . . . . 62.310000000000002 111.774 -173.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 108.67 -6.86 33.56 Favored Glycine 0 N--CA 1.449 -0.454 0 N-CA-C 110.626 -0.989 . . . . 34.350000000000001 110.626 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.7 mm -108.42 111.93 38.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.379 -0.6 . . . . 73.319999999999993 109.379 177.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.574 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 62.0 mt -89.61 108.91 19.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 109.268 -0.641 . . . . 71.230000000000004 109.268 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.23 142.44 51.53 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.31 0.576 . . . . 75.549999999999997 110.614 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.544 ' HB2' ' O ' ' A' ' 66' ' ' LYS . 21.2 ptm -139.5 152.2 46.77 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.45 -0.795 . . . . 74.030000000000001 109.893 -179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -120.83 121.14 37.49 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.354 -0.61 . . . . 74.040000000000006 109.354 -174.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.4 mtm -135.25 163.85 29.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.503 0.668 . . . . 74.540000000000006 112.598 -172.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.569 ' O ' ' HE3' ' A' ' 64' ' ' LYS . 4.9 pt-20 -151.9 178.16 9.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.372 -1.285 . . . . 73.310000000000002 107.548 169.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.8 141.37 28.56 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.833 0.349 . . . . 73.230000000000004 110.523 -179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.7 tp -101.82 -49.66 3.91 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.586 -0.894 . . . . 73.030000000000001 108.586 175.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.523 ' HG3' ' H ' ' A' ' 86' ' ' GLU . 6.3 tp-100 -124.76 158.33 33.56 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.065 -1.425 . . . . 73.150000000000006 107.79 173.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -61.74 -20.77 63.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.02 0.438 . . . . 74.200000000000003 111.096 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.523 ' H ' ' HG3' ' A' ' 84' ' ' GLN . 44.1 tt0 -76.49 -40.78 49.25 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.415 0.524 . . . . 55.329999999999998 112.415 -176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -79.93 -5.95 56.58 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.934 0.397 . . . . 75.540000000000006 111.682 -173.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -101.17 112.97 25.59 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.605 -0.887 . . . . 74.450000000000003 108.605 171.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.582 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -172.44 -119.47 0.52 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 119.536 -1.316 . . . . 72.209999999999994 114.335 -175.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.2 m -86.72 103.23 14.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.007 0.432 . . . . 72.239999999999995 112.111 -172.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -95.55 133.28 39.75 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.978 -0.555 . . . . 75.310000000000002 109.809 175.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 53.9 m -143.4 104.24 4.22 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.076 0.465 . . . . 65.129999999999995 110.011 174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.495 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 0.8 OUTLIER -100.86 112.68 25.16 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.876 -0.602 . . . . 61.520000000000003 109.942 -177.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 103' ' ' HIS . 0.1 OUTLIER -100.67 117.01 33.93 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.809 -0.441 . . . . 73.010000000000005 109.809 -176.282 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.594 HG12 HG23 ' A' ' 50' ' ' VAL . 33.1 mt -117.91 119.93 63.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.234 -0.439 . . . . 70.439999999999998 111.0 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -105.64 103.76 13.34 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.832 0.349 . . . . 72.150000000000006 110.129 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -111.28 101.41 9.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.134 -0.484 . . . . 75.340000000000003 110.539 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 69.32 -76.73 0.35 Allowed Glycine 0 CA--C 1.519 0.312 0 CA-C-N 115.828 -0.624 . . . . 64.150000000000006 113.161 178.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.401 ' NZ ' ' HB3' ' A' ' 99' ' ' LYS . 3.9 mmmp? -126.01 -39.95 2.05 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.89 0.376 . . . . 64.010000000000005 110.829 -177.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -86.83 136.84 32.83 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 43.32 111.454 -173.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.7 p -108.66 114.79 28.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.975 -0.557 . . . . 64.230000000000004 110.042 174.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -110.61 112.17 3.2 Favored Glycine 0 N--CA 1.439 -1.126 0 CA-C-N 115.67 -0.696 . . . . 73.129999999999995 111.498 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.531 ' HB3' ' HG2' ' A' ' 94' ' ' GLN . 21.6 p80 -107.31 131.98 53.63 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.598 -0.519 . . . . 71.5 109.598 178.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 17.4 t -105.73 109.12 20.97 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.114 -0.699 . . . . 50.509999999999998 109.114 178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 25.0 m -98.15 119.34 36.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.931 -0.577 . . . . 73.230000000000004 109.682 178.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.446 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -140.71 125.96 18.63 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.968 -0.752 . . . . 74.319999999999993 108.968 -178.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.2 p -114.47 122.16 68.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.956 0.407 . . . . 63.109999999999999 111.178 -175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 113' ' ' TYR . 91.6 mt -123.65 103.87 8.67 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-N 116.093 -0.503 . . . . 55.229999999999997 110.179 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.582 HG12 ' HA2' ' A' ' 89' ' ' GLY . 18.0 mt -142.55 126.27 14.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 121.048 -0.261 . . . . 72.540000000000006 110.715 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 44.3 -121.94 4.24 Favored Glycine 0 CA--C 1.522 0.479 0 O-C-N 123.742 0.651 . . . . 74.329999999999998 114.033 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 6.2 t70 -56.67 -32.55 65.51 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.36 0.664 . . . . 65.409999999999997 112.006 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 58.1 t -59.28 -50.95 77.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.587 -0.279 . . . . 73.230000000000004 110.885 -178.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HB3' ' HB3' ' A' ' 108' ' ' LEU . 1.4 p90 -72.64 -19.39 61.46 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.044 -0.662 . . . . 64.109999999999999 111.653 -177.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 28.6 pttt -72.29 -33.82 67.7 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.603 -0.439 . . . . 74.319999999999993 110.419 -177.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -75.06 -39.71 60.74 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 120.724 -0.391 . . . . 73.200000000000003 110.263 -178.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 29' ' ' ILE . 11.0 mp -60.66 -37.05 80.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.736 0.303 . . . . 63.409999999999997 110.513 177.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 31' ' ' GLU . 48.3 mt-30 -65.11 -46.78 79.6 Favored 'General case' 0 C--O 1.223 -0.331 0 CA-C-N 116.246 -0.434 . . . . 71.349999999999994 110.206 174.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 21.8 ttpp -63.9 -32.13 73.55 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.967 0.413 . . . . 75.310000000000002 111.489 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -75.27 -41.24 57.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.486 -0.324 . . . . 74.319999999999993 111.26 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.71 -44.48 49.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.028 0.442 . . . . 50.0 110.588 179.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.818 ' HG3' ' H ' ' A' ' 31' ' ' GLU . 4.7 mm-40 -99.08 88.56 3.99 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 61.439999999999998 109.947 179.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 57.0 t80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.738 -0.649 . . . . 50.020000000000003 109.597 -179.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 . . . . . 0 N--CA 1.483 1.181 0 N-CA-C 109.706 -0.479 . . . . 73.219999999999999 109.706 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -122.63 138.11 54.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.449 -0.341 . . . . 75.519999999999996 110.131 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 6' ' ' ARG . 80.1 mt-10 -81.45 89.56 6.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.901 0.381 . . . . 72.219999999999999 110.09 177.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.3 ttt -63.09 -30.05 71.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.099 0.476 . . . . 70.420000000000002 110.485 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -56.5 -34.3 66.84 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.684 -0.689 . . . . 73.439999999999998 111.953 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.577 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 29.7 ptt85 -79.07 -15.54 58.05 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.523 -0.471 . . . . 64.129999999999995 111.328 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.7 tt -61.57 -30.61 70.78 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.217 0.532 . . . . 74.200000000000003 109.594 178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.22 -13.61 60.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.665 -0.698 . . . . 73.340000000000003 110.87 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.559 ' HA ' ' HG3' ' A' ' 36' ' ' ARG . . . -89.77 -23.42 21.77 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.403 -0.362 . . . . 71.239999999999995 110.572 178.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 10' ' ' LEU . 3.9 mm? -66.09 120.29 12.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.141 0.496 . . . . 65.299999999999997 111.174 178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.5 t -137.27 154.77 50.05 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.495 -0.928 . . . . 64.140000000000001 108.495 176.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -71.81 150.12 44.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.948 -0.39 . . . . 70.230000000000004 109.948 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.32 137.83 58.24 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 120.93 0.395 . . . . 73.420000000000002 110.401 179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -142.15 100.19 3.67 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 110.231 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -74.73 98.07 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.84 -0.618 . . . . 65.409999999999997 109.771 177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB3' ' HD3' ' A' ' 17' ' ' PRO . 74.3 t80 -90.88 -52.67 0.3 Allowed Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.767 -0.652 . . . . 74.200000000000003 111.038 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.702 ' HD3' ' HB3' ' A' ' 16' ' ' PHE . 8.0 Cg_exo -72.75 142.32 35.45 Favored 'Trans proline' 0 C--N 1.355 0.894 0 C-N-CA 121.872 1.714 . . . . 72.310000000000002 111.65 176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 2.7 m -76.11 100.21 4.9 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.999 -0.371 . . . . 51.409999999999997 109.999 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.5 p -164.05 137.81 4.31 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 116.107 -0.497 . . . . 73.519999999999996 110.056 -177.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.07 -42.59 22.77 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.135 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 23' ' ' SER . 19.1 m -72.3 135.98 46.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.801 -0.636 . . . . 64.129999999999995 109.956 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 40' ' ' GLN . 45.3 mtmt -107.74 16.26 23.8 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.04 0.448 . . . . 72.239999999999995 111.063 -175.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 21' ' ' THR . 7.7 t -98.76 78.3 2.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.374 0.607 . . . . 74.230000000000004 109.957 -177.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -135.23 153.0 52.08 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.465 -0.939 . . . . 73.120000000000005 108.465 176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.71 HD21 ' CZ ' ' A' ' 37' ' ' PHE . 0.3 OUTLIER -83.19 123.27 29.4 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.002 0.43 . . . . 60.340000000000003 111.317 -171.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -118.51 138.49 52.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 70.310000000000002 110.287 176.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 8.3 p -143.06 140.05 27.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.455 -0.339 . . . . 71.200000000000003 110.594 -177.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -126.75 120.46 29.42 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 178.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 22.4 mt -99.0 135.27 34.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.709 0.29 . . . . 64.409999999999997 111.487 -173.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 82.5 mt -114.57 107.35 15.38 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.421 -0.955 . . . . 73.530000000000001 108.421 169.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.645 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -69.19 -13.86 62.65 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.639 0.607 . . . . 72.420000000000002 112.639 -169.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.645 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 29.9 mtmm -86.77 -0.09 55.74 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.74 0.274 . . . . 72.010000000000005 111.74 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 173.22 -82.86 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 119.031 -1.557 . . . . 62.100000000000001 114.775 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 79' ' ' PHE . 4.8 tp60 -89.65 160.14 16.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.293 0.568 . . . . 74.299999999999997 112.467 -164.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -128.54 129.41 68.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.742 -0.663 . . . . 73.299999999999997 109.582 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.559 ' HG3' ' HA ' ' A' ' 9' ' ' ALA . 45.9 ttm180 -97.49 122.49 40.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 62.009999999999998 111.007 -177.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.71 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 10.8 t80 -115.29 126.11 54.09 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.715 -0.675 . . . . 75.319999999999993 109.198 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 23.0 p-90 -151.0 143.21 24.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.011 0.434 . . . . 74.530000000000001 111.29 178.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.409 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 15.0 ptm -141.97 155.71 45.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.991 -0.549 . . . . 55.439999999999998 110.21 177.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' LYS . 58.7 mt-30 -104.68 110.3 22.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.388 -0.369 . . . . 73.019999999999996 110.766 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -91.51 96.81 10.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.868 -0.79 . . . . 72.349999999999994 108.868 171.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' LYS . 6.0 pt-20 -73.29 -24.19 60.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.043 -0.526 . . . . 75.319999999999993 110.903 -176.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.529 ' HG3' ' HG3' ' A' ' 42' ' ' GLU . 59.6 mttp -109.06 139.99 43.21 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.865 -0.607 . . . . 74.420000000000002 109.651 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -107.31 -21.24 13.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.144 0.497 . . . . 71.409999999999997 110.253 -176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.2 m -72.65 158.97 34.62 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.807 -0.812 . . . . 61.130000000000003 108.807 172.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.2 t -75.96 73.43 2.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.766 0.793 . . . . 74.430000000000007 110.713 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.39 -29.64 7.44 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.969 -1.014 . . . . 65.030000000000001 109.169 172.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.68 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -95.76 126.76 41.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.09 -0.959 . . . . 52.310000000000002 110.772 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 95' ' ' ILE . 9.2 mptt -110.35 111.7 23.15 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.693 -0.484 . . . . 71.340000000000003 109.693 176.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.467 HG22 HG23 ' A' ' 95' ' ' ILE . 43.4 t -102.83 122.21 54.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.149 -0.478 . . . . 72.25 109.871 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.9 p -103.18 122.08 43.99 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.86 0.362 . . . . 61.409999999999997 110.974 -179.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.81 80.34 7.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.412 -0.588 . . . . 73.239999999999995 109.412 176.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.629 ' HB ' ' O ' ' A' ' 92' ' ' THR . 50.2 mm -100.56 116.75 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.799 -0.637 . . . . 75.040000000000006 111.649 -174.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 59' ' ' ILE . 31.5 t80 -119.34 113.53 20.96 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.615 -0.72 . . . . 74.209999999999994 109.268 173.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.402 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 3.1 t-20 58.18 35.88 25.37 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.394 0.616 . . . . 73.430000000000007 109.762 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 43.8 mt-10 71.69 12.16 6.36 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.064 -0.971 . . . . 65.510000000000005 111.908 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -111.97 135.27 52.83 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.704 -0.48 . . . . 65.109999999999999 109.704 177.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -73.5 124.51 26.0 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.648 -0.501 . . . . 73.019999999999996 109.648 173.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.406 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.3 pt -109.93 167.45 4.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.029 -0.532 . . . . 73.25 112.126 -173.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -132.05 162.05 31.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.043 -0.98 . . . . 73.019999999999996 109.003 178.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.519 ' CD ' ' HD3' ' A' ' 66' ' ' LYS . 29.0 tt0 -59.44 142.75 51.65 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 123.432 0.457 . . . . 74.409999999999997 110.467 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -170.29 -119.36 0.5 Allowed Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.518 -0.849 . . . . 43.200000000000003 112.816 -176.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.407 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 15.4 Cg_exo -67.69 -75.73 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.244 2.629 . . . . 65.120000000000005 113.067 -174.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.701 ' HE2' ' OD2' ' A' ' 87' ' ' ASP . 49.6 pttt -95.2 -0.54 53.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.847 0.356 . . . . 65.200000000000003 110.629 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 64' ' ' LYS . 95.9 m-85 -101.27 128.84 47.23 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.239 -0.437 . . . . 75.150000000000006 110.88 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.573 ' O ' ' HG3' ' A' ' 78' ' ' MET . 36.9 mmtt -134.65 116.44 14.96 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.342 -0.844 . . . . 74.439999999999998 108.934 172.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.43 ' HG2' ' HB2' ' A' ' 61' ' ' GLU . 22.2 ptp -132.04 115.1 15.38 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.351 0.596 . . . . 65.129999999999995 110.315 -173.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.42 ' HB2' ' OE2' ' A' ' 77' ' ' GLU . 15.1 m80 -109.7 115.65 30.27 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.033 -0.531 . . . . 72.329999999999998 110.257 -175.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 4.9 tp -94.27 101.3 12.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.545 0.688 . . . . 74.239999999999995 110.708 179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -95.07 134.93 37.22 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.856 -0.611 . . . . 73.319999999999993 110.423 176.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -122.02 12.2 10.37 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.729 -0.668 . . . . 70.030000000000001 109.726 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.4 m-80 -99.18 -46.75 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.574 -0.739 . . . . 70.409999999999997 111.146 -177.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.9 p -115.4 -30.47 6.24 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.46 -0.336 . . . . 73.450000000000003 111.405 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.96 6.55 51.91 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.686 -0.769 . . . . 73.329999999999998 112.381 178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.0 mm -88.21 104.4 14.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.618 -0.512 . . . . 64.209999999999994 109.618 178.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.409 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 76.6 mt -109.11 116.1 51.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.835 -0.62 . . . . 62.229999999999997 110.001 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.42 ' OE2' ' HB2' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -122.32 163.98 18.75 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.569 0.7 . . . . 74.519999999999996 111.179 178.713 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.603 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.1 ttm -146.06 143.71 29.57 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.069 -0.969 . . . . 64.310000000000002 109.466 -177.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.452 ' CZ ' ' HG2' ' A' ' 34' ' ' GLN . 2.3 t80 -119.87 113.77 21.07 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.965 -0.383 . . . . 72.230000000000004 109.965 -175.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 64' ' ' LYS . 58.9 mtm -138.89 176.41 8.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.449 0.642 . . . . 31.239999999999998 111.74 -178.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HB3' ' NE2' ' A' ' 34' ' ' GLN . 9.9 pt-20 -168.48 -161.39 0.35 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.588 -1.187 . . . . 72.439999999999998 108.134 170.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.528 ' HD2' ' O ' ' A' ' 82' ' ' LYS . 0.7 OUTLIER -88.7 153.81 20.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.734 0.302 . . . . 75.510000000000005 110.726 178.496 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.429 ' HG ' ' HG3' ' A' ' 84' ' ' GLN . 51.5 tp -138.64 -74.48 0.39 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.201 -0.454 . . . . 75.519999999999996 109.898 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HG3' ' HG ' ' A' ' 83' ' ' LEU . 26.9 mt-30 -140.03 146.07 38.55 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.13 -0.693 . . . . 64.120000000000005 109.13 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -62.69 -24.81 67.84 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.821 0.304 . . . . 71.109999999999999 111.821 -173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.81 -27.3 55.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.123 0.487 . . . . 64.439999999999998 110.748 176.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.701 ' OD2' ' HE2' ' A' ' 64' ' ' LYS . 21.0 t70 -97.04 -15.62 20.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.552 0.691 . . . . 65.0 109.706 -175.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 108' ' ' LEU . 0.5 OUTLIER -78.29 129.5 35.11 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.418 -0.81 . . . . 74.0 109.385 168.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.53 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -154.95 -168.53 18.34 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.038 -1.077 . . . . 71.109999999999999 112.745 -176.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.5 m -81.29 110.86 17.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.722 0.296 . . . . 75.150000000000006 110.832 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -84.82 121.83 28.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.951 -0.759 . . . . 73.010000000000005 108.951 174.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.629 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 30.2 m -126.42 113.2 16.54 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.952 0.406 . . . . 74.219999999999999 110.416 -178.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -114.57 104.22 11.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.026 0.441 . . . . 73.219999999999999 110.974 -178.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -98.98 118.99 37.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.382 -0.826 . . . . 74.200000000000003 109.18 176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 49' ' ' LYS . 44.6 mt -122.5 109.82 25.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.761 0.315 . . . . 73.150000000000006 111.062 -176.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.68 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 55.1 tt0 -96.07 105.76 17.84 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.617 -0.512 . . . . 71.439999999999998 109.617 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 48' ' ' ALA . 23.5 t70 -108.73 88.02 2.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.146 0.498 . . . . 73.439999999999998 110.222 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 72.63 -68.4 1.24 Allowed Glycine 0 CA--C 1.52 0.383 0 CA-C-N 115.752 -0.658 . . . . 43.329999999999998 112.973 178.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -126.38 -63.06 1.11 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.91 0.386 . . . . 72.420000000000002 111.052 -175.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.47 149.27 36.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 71.140000000000001 110.641 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.431 HG22 ' HA ' ' A' ' 96' ' ' GLN . 5.1 p -111.69 114.38 27.37 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.1 0.476 . . . . 73.340000000000003 111.296 177.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -73.85 151.19 43.95 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.005 -1.238 . . . . 75.219999999999999 110.005 171.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -167.98 128.99 1.4 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.306 0.574 . . . . 74.430000000000007 111.664 -172.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.471 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 24.6 t -140.15 134.31 31.04 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.56 -0.745 . . . . 52.200000000000003 109.512 172.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 19.5 m -104.62 117.86 35.14 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.175 -0.676 . . . . 62.210000000000001 109.175 172.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -122.78 100.1 6.73 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.849 -0.797 . . . . 72.239999999999995 108.849 -178.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.3 p -104.72 114.33 44.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.243 0.545 . . . . 73.439999999999998 111.2 -176.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.499 ' O ' ' HB3' ' A' ' 88' ' ' GLU . 89.1 mt -119.31 103.31 9.38 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.315 -0.624 . . . . 75.299999999999997 109.315 175.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.53 HG12 ' HA2' ' A' ' 89' ' ' GLY . 51.2 mt -146.74 126.98 5.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 110.033 -0.358 . . . . 73.209999999999994 110.033 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.81 -113.03 1.04 Allowed Glycine 0 CA--C 1.522 0.484 0 O-C-N 123.794 0.684 . . . . 34.32 114.155 174.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 23.8 t70 -74.59 -25.54 59.33 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.236 0.541 . . . . 64.329999999999998 110.97 -177.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.41 -44.42 94.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.708 -0.678 . . . . 63.109999999999999 111.467 -176.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.2 p90 -66.42 -24.95 66.54 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 120.167 -0.613 . . . . 74.030000000000001 112.067 -174.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 0.8 OUTLIER -76.65 -19.2 58.04 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 120.109 -0.637 . . . . 74.540000000000006 110.176 -178.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -68.5 -47.77 66.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.499 -0.556 . . . . 72.450000000000003 109.499 175.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.63 -34.05 77.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.646 -0.707 . . . . 70.519999999999996 110.028 177.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.512 ' HB2' ' HA ' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -61.16 -37.29 82.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.888 -0.596 . . . . 73.329999999999998 110.85 176.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.401 ' HE2' ' HB3' ' A' ' 118' ' ' LYS . 46.1 mtpt -64.44 -37.15 86.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.863 0.363 . . . . 75.319999999999993 111.079 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -81.93 -10.98 59.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.13 -0.486 . . . . 65.200000000000003 111.203 -177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.1 -66.86 0.67 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.227 -0.442 . . . . 42.229999999999997 111.686 -176.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.493 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 41.5 mt-10 -126.44 -158.13 0.84 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.536 -0.302 . . . . 65.430000000000007 111.413 -175.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.419 ' HB2' ' O ' ' A' ' 121' ' ' GLU . 2.8 m-85 . . . . . 0 C--O 1.249 1.029 0 C-N-CA 123.662 0.785 . . . . 71.150000000000006 110.557 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.874 0.369 . . . . 75.030000000000001 110.46 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -103.72 119.37 38.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.232 -0.44 . . . . 61.030000000000001 109.983 178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -91.38 111.66 23.25 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.199 -0.667 . . . . 71.219999999999999 109.199 -179.06 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.1 ttm -69.32 -40.93 77.34 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.614 0.598 . . . . 72.120000000000005 112.614 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 5' ' ' LYS . 3.1 mppt? -71.4 -28.82 64.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.268 0.556 . . . . 61.240000000000002 109.708 -178.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.597 ' HB2' ' HB3' ' A' ' 3' ' ' GLU . 3.9 tpp180 -57.95 -33.56 68.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.081 -0.963 . . . . 72.310000000000002 111.353 -178.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 89.7 mt -66.75 -27.31 67.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.288 -0.414 . . . . 72.200000000000003 110.979 -179.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.4 mp -91.08 -25.63 19.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.967 0.413 . . . . 73.420000000000002 111.042 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -82.22 -54.57 5.15 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.466 -0.334 . . . . 63.109999999999999 111.017 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.58 115.87 6.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.999 -0.546 . . . . 62.149999999999999 110.071 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.3 m -110.28 -172.34 2.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.807 -0.633 . . . . 61.039999999999999 110.475 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -72.53 125.13 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.53 -0.304 . . . . 71.400000000000006 110.534 -178.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.548 ' HG2' ' HG3' ' A' ' 40' ' ' GLN . 27.9 mt-10 -56.64 112.37 1.27 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.582 -0.281 . . . . 72.239999999999995 110.922 175.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -142.14 106.09 4.73 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.016 -0.364 . . . . 74.319999999999993 110.016 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.729 ' HG3' ' HB2' ' A' ' 24' ' ' GLU . 12.8 mptt -74.86 131.31 40.65 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.278 -0.638 . . . . 74.409999999999997 109.278 174.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.671 ' HB2' ' HD3' ' A' ' 17' ' ' PRO . 91.3 m-85 -94.61 -54.66 0.23 Allowed Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 112.469 0.544 . . . . 64.200000000000003 112.469 -173.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.671 ' HD3' ' HB2' ' A' ' 16' ' ' PHE . 76.5 Cg_endo -88.38 -157.87 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.103 1.869 . . . . 62.130000000000003 112.452 -179.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.1 m -127.52 125.75 40.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.084 -0.507 . . . . 60.340000000000003 109.834 176.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -151.13 140.84 14.08 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.741 -0.466 . . . . 63.219999999999999 109.741 -176.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.81 66.75 0.88 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.785 2.323 . . . . 53.219999999999999 113.128 177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 23' ' ' SER . 9.2 t 179.02 -179.43 0.36 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.203 -0.665 . . . . 54.25 109.203 175.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -115.46 20.28 14.87 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.869 -0.419 . . . . 64.140000000000001 109.869 176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 26.6 t -98.28 109.46 22.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.415 -0.811 . . . . 53.299999999999997 109.931 -179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.729 ' HB2' ' HG3' ' A' ' 15' ' ' LYS . 7.8 tp10 -112.24 132.15 55.09 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.522 -0.763 . . . . 73.200000000000003 109.973 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 95' ' ' ILE . 1.5 tm? -106.67 107.79 18.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.227 -0.657 . . . . 61.200000000000003 109.227 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -109.73 107.23 17.17 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.151 0.5 . . . . 71.310000000000002 110.856 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 5.6 p -97.14 123.46 49.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.923 -0.58 . . . . 55.409999999999997 109.621 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.513 ' HB3' ' HB3' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -109.32 120.79 43.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.161 -0.472 . . . . 71.310000000000002 110.418 -176.626 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.418 HD13 ' HB3' ' A' ' 116' ' ' LEU . 60.2 mt -111.3 114.11 46.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.728 -0.669 . . . . 71.510000000000005 110.898 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 34' ' ' GLN . 3.4 mm? -99.48 154.45 18.22 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.876 -0.786 . . . . 60.240000000000002 108.876 172.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 121' ' ' GLU . 5.1 pm0 -79.46 2.54 21.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.491 0.662 . . . . 75.019999999999996 110.893 -173.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 46.1 mttm -95.54 3.64 53.94 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.494 -0.775 . . . . 63.119999999999997 110.397 -177.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.07 85.97 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.558 -0.829 . . . . 34.119999999999997 111.091 -173.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.721 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -78.23 102.75 7.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.552 -0.324 . . . . 72.340000000000003 110.292 178.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -93.64 112.27 26.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.612 0.72 . . . . 71.510000000000005 109.973 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.513 ' HB3' ' HB3' ' A' ' 28' ' ' GLU . 42.9 ttp180 -101.81 110.75 22.8 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.687 -0.688 . . . . 75.319999999999993 109.814 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.507 ' CZ ' HD21 ' A' ' 25' ' ' LEU . 66.9 t80 -106.59 125.32 50.85 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.887 -0.597 . . . . 71.430000000000007 110.181 -177.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 2.9 p-90 -150.06 120.94 7.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.14 -0.482 . . . . 74.129999999999995 109.872 177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 26.5 ptm -114.0 140.41 48.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.254 0.55 . . . . 74.519999999999996 110.605 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.569 ' HB2' ' HB3' ' A' ' 24' ' ' GLU . 1.9 mp0 -97.97 110.2 22.82 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.412 -0.813 . . . . 72.219999999999999 109.847 -177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -110.15 154.58 23.11 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.765 -0.457 . . . . 72.310000000000002 109.765 176.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.492 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.54 -49.97 28.9 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.81 0.338 . . . . 71.010000000000005 110.574 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.492 ' HD2' ' C ' ' A' ' 42' ' ' GLU . 3.6 mptp? -139.14 175.64 9.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.293 -0.632 . . . . 70.430000000000007 109.293 176.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.841 ' HG ' ' HA ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -108.57 -0.97 20.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.406 0.622 . . . . 60.229999999999997 109.894 176.842 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 17.5 m -100.32 110.38 22.61 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.568 -0.742 . . . . 70.140000000000001 110.433 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.4 t -171.44 153.01 3.4 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.761 -0.654 . . . . 61.149999999999999 109.269 177.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -82.57 72.92 9.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.275 0.56 . . . . 72.349999999999994 109.7 176.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -148.24 153.91 39.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.595 -0.729 . . . . 63.25 110.169 -177.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -117.9 137.35 52.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.418 -0.356 . . . . 64.129999999999995 110.535 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.7 p -103.28 118.95 51.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.321 0.582 . . . . 75.140000000000001 110.549 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.462 ' HB3' HG12 ' A' ' 53' ' ' ILE . 49.2 m -93.38 104.73 16.87 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.072 -0.513 . . . . 65.25 111.638 -176.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.587 ' O ' ' HA ' ' A' ' 58' ' ' GLU . 68.1 m-85 -80.32 83.72 6.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 108.873 -0.788 . . . . 71.219999999999999 108.873 172.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.804 ' HB ' ' O ' ' A' ' 92' ' ' THR . 34.0 mm -101.74 119.48 50.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.588 0.709 . . . . 73.530000000000001 112.382 -169.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 59' ' ' ILE . 27.0 t80 -126.79 120.51 29.49 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.895 -1.048 . . . . 71.239999999999995 108.747 171.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 63.83 30.44 14.46 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.54 0.686 . . . . 75.219999999999999 109.416 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 70.44 12.18 7.44 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.742 -1.117 . . . . 62.340000000000003 111.712 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -117.5 135.58 53.83 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.373 -0.376 . . . . 73.349999999999994 110.354 178.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' TYR . 42.8 mt-10 -68.94 137.46 53.8 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.157 -0.683 . . . . 75.340000000000003 109.157 173.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.457 ' CG2' ' HB3' ' A' ' 54' ' ' PHE . 7.4 pt -107.73 178.97 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.35 0.595 . . . . 75.409999999999997 112.566 -169.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -132.79 160.46 36.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.122 -0.944 . . . . 70.209999999999994 110.431 -175.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -68.51 125.64 27.13 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.033 -0.728 . . . . 54.539999999999999 109.033 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -154.46 -150.47 5.52 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.222 -0.99 . . . . 71.430000000000007 113.071 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -64.11 -58.26 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.76 2.306 . . . . 72.209999999999994 112.873 -177.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.545 ' HE2' ' O ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -99.57 -12.62 19.94 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.807 -0.357 . . . . 75.230000000000004 111.118 -177.13 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HD1' ' HE1' ' A' ' 80' ' ' MET . 1.1 m-85 -97.0 127.23 42.76 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.414 -0.587 . . . . 74.040000000000006 109.414 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.9 tptt -144.03 116.34 8.51 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.817 -0.438 . . . . 72.140000000000001 109.817 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -109.78 158.6 17.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.446 -0.343 . . . . 71.450000000000003 110.109 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -138.82 117.92 12.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.331 -0.395 . . . . 71.230000000000004 110.21 -178.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 10.4 tt -137.71 116.36 14.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.038 0.447 . . . . 65.340000000000003 109.953 177.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -105.55 173.97 6.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.194 0.521 . . . . 73.140000000000001 110.863 -176.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.841 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -129.69 22.74 5.44 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.64 -0.709 . . . . 63.340000000000003 109.854 177.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 -97.89 -47.51 5.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 73.530000000000001 109.49 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.2 m -122.53 -48.43 2.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.276 -0.874 . . . . 34.409999999999997 110.064 179.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.25 52.23 0.53 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.635 -0.793 . . . . 62.0 112.847 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.6 mm -114.02 112.03 38.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.005 0.431 . . . . 72.099999999999994 110.106 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 39' ' ' MET . 69.7 mt -92.84 121.18 43.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.87 -0.605 . . . . 72.340000000000003 110.452 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -125.13 165.39 18.3 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.685 -0.689 . . . . 72.209999999999994 110.911 -177.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB3' ' A' ' 37' ' ' PHE . 58.3 ttp -153.86 134.14 13.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.618 -0.719 . . . . 51.409999999999997 109.418 172.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -131.93 130.67 41.85 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.83 -0.433 . . . . 65.049999999999997 109.83 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HE1' ' HD1' ' A' ' 65' ' ' TYR . 58.4 mtt -133.55 141.87 47.91 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.48 0.657 . . . . 65.209999999999994 112.53 -176.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.545 ' O ' ' HE2' ' A' ' 64' ' ' LYS . 8.9 tp10 -115.57 168.49 9.96 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.158 -1.423 . . . . 44.32 107.158 168.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 ptpp? -87.41 141.44 28.63 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.068 0.461 . . . . 75.299999999999997 110.557 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -124.56 -68.61 0.85 Allowed 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.033 -1.099 . . . . 74.219999999999999 108.033 176.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -128.56 161.36 29.76 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.932 -0.766 . . . . 52.140000000000001 108.932 168.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.8 -11.63 61.07 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.912 0.387 . . . . 71.209999999999994 111.135 -177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -76.0 -20.62 57.7 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.048 0.451 . . . . 71.239999999999995 110.341 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -84.36 -9.68 58.23 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.82 -0.627 . . . . 72.310000000000002 110.301 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -101.21 163.22 12.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.456 -0.793 . . . . 72.200000000000003 109.54 177.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 159.89 -145.36 11.18 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.238 -0.982 . . . . 74.430000000000007 112.764 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 12.0 m -93.28 114.72 27.24 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 73.430000000000007 110.672 -179.189 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -99.38 112.29 24.5 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.483 -0.562 . . . . 70.409999999999997 109.483 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.804 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 67.2 m -117.6 103.58 10.19 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.517 -0.549 . . . . 60.049999999999997 109.517 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -89.94 110.16 21.13 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.515 -0.55 . . . . 62.119999999999997 109.515 -177.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -97.28 116.54 29.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.302 -0.629 . . . . 73.349999999999994 109.302 -179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 25' ' ' LEU . 54.1 mt -108.53 122.49 63.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.05 -0.523 . . . . 73.099999999999994 111.056 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -98.43 110.49 23.07 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.881 -0.785 . . . . 75.120000000000005 108.881 171.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.564 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 6.3 t70 -108.73 168.83 9.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.766 -0.652 . . . . 72.430000000000007 109.287 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -53.76 -34.6 51.04 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.377 -0.44 . . . . 73.040000000000006 112.516 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.435 ' HE3' ' HB2' ' A' ' 99' ' ' LYS . 8.9 ttmt -137.88 -28.89 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.512 -0.405 . . . . 74.340000000000003 111.376 177.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.564 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -82.89 140.77 32.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.102 0.477 . . . . 75.329999999999998 110.927 179.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 24.3 m -144.65 120.73 10.76 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 122.146 -0.346 . . . . 73.329999999999998 110.728 176.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -165.28 -178.84 38.75 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.951 -0.642 . . . . 72.209999999999994 112.093 -179.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -139.31 133.48 31.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.64 0.257 . . . . 60.439999999999998 110.329 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 20.2 m -101.03 109.75 21.69 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.405 -0.591 . . . . 74.319999999999993 109.405 176.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.8 m -107.16 118.76 37.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.257 0.551 . . . . 63.310000000000002 111.138 -175.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 106' ' ' LEU . 1.1 tm? -132.05 118.84 20.2 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.756 -0.831 . . . . 64.230000000000004 108.756 177.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.6 p -109.89 128.38 66.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.057 0.456 . . . . 72.409999999999997 111.655 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 89.3 mt -130.09 101.8 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.046 -0.525 . . . . 63.229999999999997 110.186 175.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -159.1 149.7 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 75.140000000000001 110.329 174.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.74 -128.05 24.3 Favored Glycine 0 CA--C 1.52 0.356 0 O-C-N 123.616 0.573 . . . . 63.399999999999999 113.981 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 17.4 t70 -74.59 -24.0 58.82 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.46 0.648 . . . . 73.200000000000003 110.223 -179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.9 -37.05 79.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.633 -0.712 . . . . 64.209999999999994 112.09 -173.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' GLN . 2.0 p90 -69.2 -19.93 63.98 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.034 -0.666 . . . . 74.010000000000005 111.709 -175.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 36.2 pttt -75.17 -25.76 58.56 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.961 -0.385 . . . . 74.310000000000002 109.961 -178.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 58.1 tttp -65.07 -54.08 35.66 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.669 -0.493 . . . . 61.229999999999997 109.669 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.418 ' HB3' HD13 ' A' ' 29' ' ' ILE . 3.3 mm? -64.12 -31.95 73.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.88 -0.6 . . . . 73.310000000000002 110.023 177.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -65.93 -55.59 16.08 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.789 -0.641 . . . . 73.409999999999997 111.407 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -76.57 -24.15 53.54 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.63 0.604 . . . . 62.420000000000002 112.63 -173.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -89.52 -11.44 42.85 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.363 -0.535 . . . . 71.310000000000002 111.419 -177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -97.86 -45.41 6.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.758 0.313 . . . . 61.109999999999999 110.169 176.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.649 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 0.0 OUTLIER -131.05 145.67 52.11 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.707 -0.679 . . . . 65.340000000000003 109.284 177.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.754 -0.641 . . . . 75.120000000000005 110.574 -176.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.957 0.408 . . . . 71.010000000000005 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -124.88 75.26 1.42 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.702 -0.481 . . . . 70.450000000000003 109.702 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.3 mp0 -80.94 155.79 26.3 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.681 -0.691 . . . . 71.230000000000004 111.452 -174.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -62.74 -23.67 67.3 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.867 -0.606 . . . . 70.540000000000006 112.004 -176.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.581 ' HB3' ' HE2' ' A' ' 79' ' ' PHE . 28.0 mmtp -52.89 -39.01 62.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.894 0.378 . . . . 71.129999999999995 110.873 175.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 45.2 ttm180 -73.74 -23.23 59.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 111.115 -177.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.5 mt -67.9 -30.45 69.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.753 0.311 . . . . 64.450000000000003 110.788 -178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 8' ' ' LEU . 4.0 mm? -77.7 -18.55 56.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 72.030000000000001 110.637 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.722 ' HA ' ' HD2' ' A' ' 36' ' ' ARG . . . -82.13 -15.3 53.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.041 -0.527 . . . . 63.130000000000003 110.703 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 92.1 mt -75.6 151.93 37.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.929 -0.578 . . . . 73.010000000000005 110.798 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m -152.75 150.65 29.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 110.058 177.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -64.57 120.03 11.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.954 -0.567 . . . . 72.109999999999999 111.284 -179.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -91.1 93.73 9.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.011 -1.107 . . . . 72.340000000000003 108.011 173.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -142.39 17.22 2.05 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.429 -0.805 . . . . 64.349999999999994 109.469 -176.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -88.15 100.46 12.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.516 0.674 . . . . 64.319999999999993 110.981 -173.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.402 ' N ' ' CD ' ' A' ' 17' ' ' PRO . 66.5 m-85 -73.53 -39.74 4.93 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.219 -0.9 . . . . 73.120000000000005 111.762 177.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.402 ' CD ' ' N ' ' A' ' 16' ' ' PHE . 34.4 Cg_exo -62.23 83.0 0.1 OUTLIER 'Trans proline' 0 C--N 1.36 1.154 0 C-N-CA 122.073 1.849 . . . . 61.420000000000002 112.253 171.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.636 HG22 ' H ' ' A' ' 19' ' ' VAL . 24.9 m -138.77 179.88 6.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.128 -1.064 . . . . 73.129999999999995 108.128 -179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.96 ' HB ' ' HD2' ' A' ' 20' ' ' PRO . 31.6 m -94.03 177.66 1.84 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 109.856 -0.424 . . . . 61.420000000000002 109.856 -179.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.96 ' HD2' ' HB ' ' A' ' 19' ' ' VAL . 36.4 Cg_exo -35.18 -47.93 0.76 Allowed 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 123.996 3.13 . . . . 65.030000000000001 114.809 -179.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.675 ' HB ' ' OE1' ' A' ' 42' ' ' GLU . 1.3 p -100.05 -174.29 2.65 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.966 0.412 . . . . 72.230000000000004 111.912 -178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB2' ' HB3' ' A' ' 42' ' ' GLU . 13.7 mmmm -109.67 13.6 23.72 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.781 -0.451 . . . . 43.329999999999998 109.781 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 40' ' ' GLN . 25.9 m -96.45 98.21 10.06 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 121.958 0.885 . . . . 73.099999999999994 110.702 -173.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -131.15 131.61 44.2 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.43 -1.259 . . . . 74.099999999999994 110.009 -175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HB3' ' HB2' ' A' ' 104' ' ' SER . 0.9 OUTLIER -97.71 108.61 21.37 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.43 -0.581 . . . . 75.140000000000001 109.43 -178.389 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -111.9 141.99 44.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.181 0.515 . . . . 43.450000000000003 111.161 -177.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.87 129.41 68.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.705 -0.679 . . . . 75.239999999999995 109.677 178.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.669 ' HB2' ' HG3' ' A' ' 36' ' ' ARG . 58.5 mm-40 -109.38 136.81 48.2 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 61.539999999999999 110.298 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.534 ' CG2' ' HG2' ' A' ' 117' ' ' GLN . 46.6 mt -112.27 119.18 59.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.877 -0.601 . . . . 65.510000000000005 111.32 -171.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 34' ' ' GLN . 67.9 mt -128.86 105.82 8.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.424 -0.584 . . . . 74.450000000000003 109.424 173.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.933 ' HB3' ' HB3' ' A' ' 117' ' ' GLN . 2.2 pt-20 -67.4 -22.96 65.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.088 -0.505 . . . . 73.420000000000002 111.39 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -58.35 -24.89 61.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.991 -0.55 . . . . 75.310000000000002 111.384 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 135.19 46.2 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.367 -0.921 . . . . 52.210000000000001 113.358 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.604 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 60.6 tp60 -165.49 114.14 1.0 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.768 0.318 . . . . 74.420000000000002 110.877 177.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.3 t -100.78 108.28 22.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 N-CA-C 109.011 -0.737 . . . . 74.409999999999997 109.011 174.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.722 ' HD2' ' HA ' ' A' ' 9' ' ' ALA . 20.8 ptt85 -98.22 118.64 35.31 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.763 0.792 . . . . 71.510000000000005 110.638 -178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 78' ' ' MET . 23.0 t80 -100.14 130.34 46.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.701 -1.136 . . . . 72.310000000000002 109.279 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 19.0 p-90 -145.22 134.66 23.12 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.204 0.526 . . . . 74.549999999999997 109.821 174.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.441 ' CG ' ' HB ' ' A' ' 76' ' ' ILE . 12.5 ptm -133.03 142.7 48.94 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.183 -0.462 . . . . 64.420000000000002 110.361 178.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HA ' ' A' ' 23' ' ' SER . 18.6 pt20 -104.76 142.6 34.42 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.745 -0.661 . . . . 71.299999999999997 109.637 175.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -141.08 161.56 37.57 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.987 -0.552 . . . . 73.400000000000006 109.771 176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.744 ' HB3' ' HB2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -113.83 -30.24 6.81 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.996 0.427 . . . . 54.219999999999999 110.117 179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.455 ' HG2' ' OE2' ' A' ' 42' ' ' GLU . 27.9 mmmt -93.63 114.99 27.44 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 116.146 -0.479 . . . . 62.25 110.534 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -107.57 3.86 25.36 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.686 -0.857 . . . . 74.230000000000004 108.686 172.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.0 t -89.64 162.26 15.71 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.265 -1.334 . . . . 73.530000000000001 108.383 170.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 m -66.83 87.75 0.14 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.406 0.622 . . . . 70.409999999999997 111.632 -176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -149.5 -62.82 0.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.415 -0.811 . . . . 73.519999999999996 109.345 176.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.634 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -83.13 89.22 6.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.361 -0.836 . . . . 53.420000000000002 110.372 -178.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.443 ' HE2' ' HB3' ' A' ' 49' ' ' LYS . 40.8 mtpt -79.72 121.58 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.063 -0.517 . . . . 73.150000000000006 110.363 177.308 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.7 t -99.7 103.53 14.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.76 -0.654 . . . . 73.519999999999996 109.418 177.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.9 m -82.48 114.76 21.12 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.886 -0.597 . . . . 75.109999999999999 110.689 -177.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.534 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 92.2 m-85 -75.32 94.42 3.03 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.046 -0.724 . . . . 64.109999999999999 109.046 175.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.633 ' HB ' ' O ' ' A' ' 92' ' ' THR . 46.2 mm -119.45 132.7 68.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.59 0.71 . . . . 72.420000000000002 111.76 -172.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -128.97 113.41 15.15 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.137 -0.938 . . . . 63.200000000000003 108.755 173.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 8.9 t-20 55.77 45.93 23.41 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 121.206 0.527 . . . . 74.329999999999998 110.317 -179.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 57.0 mt-10 75.73 -7.15 1.85 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 115.253 -0.885 . . . . 61.409999999999997 112.831 177.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -106.61 149.83 26.79 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.918 -0.313 . . . . 61.409999999999997 110.226 -177.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -78.83 144.02 35.44 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.927 -0.397 . . . . 71.420000000000002 109.927 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.7 pt -110.11 154.76 11.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.191 0.519 . . . . 64.200000000000003 111.846 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -118.23 160.59 21.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.372 -0.831 . . . . 63.329999999999998 109.353 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -72.45 109.48 6.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.103 0.477 . . . . 73.129999999999995 110.397 -178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -140.33 -132.36 2.85 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.651 -0.704 . . . . 72.109999999999999 112.423 -177.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -77.37 -35.32 1.68 Allowed 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.877 2.385 . . . . 50.539999999999999 112.827 -177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.763 ' HG3' ' HB3' ' A' ' 87' ' ' ASP . 3.8 tmtm? -92.82 -24.58 18.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.053 0.454 . . . . 65.040000000000006 110.472 -175.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -121.25 131.57 54.3 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.515 0.561 . . . . 71.219999999999999 112.515 -167.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.49 ' O ' ' HG3' ' A' ' 78' ' ' MET . 52.3 tptt -137.06 116.73 12.97 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.056 -0.72 . . . . 65.349999999999994 109.056 170.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -107.26 159.42 16.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.22 0.533 . . . . 54.130000000000003 111.566 -174.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -126.1 119.88 28.73 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.694 -0.685 . . . . 64.209999999999994 110.16 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 12.2 tt -98.25 124.23 51.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.991 0.424 . . . . 74.430000000000007 110.473 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -126.51 142.85 51.39 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.116 -0.493 . . . . 74.219999999999999 110.873 -179.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.23 1.24 10.78 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 65.329999999999998 110.099 177.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -94.34 -53.86 3.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.122 -0.49 . . . . 63.229999999999997 111.379 -172.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.0 m -109.41 -39.05 5.31 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.326 -0.397 . . . . 63.130000000000003 111.416 -170.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 96.18 25.11 13.1 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.542 -0.837 . . . . 25.420000000000002 111.251 -175.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mm -110.6 117.8 55.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.269 -0.641 . . . . 71.25 109.269 178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.441 ' HB ' ' CG ' ' A' ' 39' ' ' MET . 73.4 mt -107.07 112.86 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 116.371 -0.377 . . . . 72.510000000000005 110.506 -178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.38 117.37 33.44 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.567 0.699 . . . . 60.530000000000001 109.809 177.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.624 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 15.7 ttt -113.43 149.72 33.8 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.41 -0.814 . . . . 74.299999999999997 110.511 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HE2' ' HB3' ' A' ' 5' ' ' LYS . 2.0 m-30 -110.05 130.59 55.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.249 0.547 . . . . 72.25 111.404 -178.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 63.3 mtt -131.0 132.13 44.8 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.102 -0.954 . . . . 64.430000000000007 109.216 173.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -114.19 -173.54 2.3 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 110.211 -0.292 . . . . 75.140000000000001 110.211 178.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.447 ' C ' HD22 ' A' ' 83' ' ' LEU . 12.2 mmmm -87.98 127.8 35.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 111.268 -175.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.755 HD23 ' HG2' ' A' ' 64' ' ' LYS . 3.5 mm? -131.39 -166.69 1.74 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.354 -0.839 . . . . 71.230000000000004 109.34 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -79.91 173.57 12.46 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.949 -0.3 . . . . 65.030000000000001 110.603 179.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -61.77 -18.85 61.43 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.395 0.887 . . . . 73.010000000000005 113.395 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -77.8 -31.92 52.09 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.588 -0.445 . . . . 73.040000000000006 110.827 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.763 ' HB3' ' HG3' ' A' ' 64' ' ' LYS . 5.4 m-20 -89.38 -31.87 17.56 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.121 0.486 . . . . 74.310000000000002 109.834 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.43 ' HA ' ' OH ' ' A' ' 91' ' ' TYR . 2.4 tp10 -88.09 91.84 8.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 75.219999999999999 108.773 175.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.575 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -146.4 -124.95 1.63 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 119.783 -1.199 . . . . 62.240000000000002 114.156 -173.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.2 m -100.1 104.86 16.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.871 0.367 . . . . 71.120000000000005 111.624 -172.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.43 ' OH ' ' HA ' ' A' ' 88' ' ' GLU . 36.4 m-85 -94.02 119.57 33.08 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.004 -0.543 . . . . 71.030000000000001 109.626 179.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.633 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 48.9 m -143.92 104.43 4.15 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.921 0.391 . . . . 61.200000000000003 110.813 179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.534 ' HE2' ' HD1' ' A' ' 52' ' ' TYR . 44.9 m-85 -95.09 136.5 35.35 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.616 -0.512 . . . . 72.200000000000003 109.616 178.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -118.56 116.48 26.73 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.922 0.391 . . . . 74.129999999999995 110.742 -177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.458 ' HB ' ' HA3' ' A' ' 102' ' ' GLY . 60.4 mt -105.31 122.72 58.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.712 -0.676 . . . . 73.120000000000005 110.229 177.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.634 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 53.2 tt0 -83.64 115.15 22.02 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.29 -0.413 . . . . 64.319999999999993 109.901 177.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.644 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 5.1 t70 -109.49 -69.14 0.88 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.241 -0.436 . . . . 62.340000000000003 110.897 -175.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 137.34 -39.85 1.57 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.857 -0.687 . . . . 54.219999999999999 111.879 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -101.36 -35.26 9.29 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.912 -0.773 . . . . 73.25 108.912 175.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.644 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -124.47 169.32 11.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.983 -1.008 . . . . 73.439999999999998 109.666 176.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.5 p -118.69 113.97 22.01 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.726 -0.472 . . . . 74.209999999999994 109.726 171.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 95' ' ' ILE . . . -81.06 65.04 4.05 Favored Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.914 -0.584 . . . . 62.43 112.753 -174.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.487 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.8 p-80 -102.73 133.24 48.09 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.097 -0.335 . . . . 63.240000000000002 110.097 177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.531 ' HB2' ' HB3' ' A' ' 25' ' ' LEU . 9.5 t -129.57 108.86 10.55 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.346 -0.613 . . . . 74.120000000000005 109.346 178.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 42.4 m -99.13 119.72 38.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.775 -0.648 . . . . 44.329999999999998 110.743 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.9 OUTLIER -138.98 118.86 13.23 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.783 -0.821 . . . . 71.510000000000005 108.783 177.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 7.3 p -110.48 127.28 67.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.144 0.497 . . . . 73.430000000000007 111.067 -177.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 113' ' ' TYR . 95.4 mt -128.74 104.35 7.58 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.946 -0.57 . . . . 62.310000000000002 110.258 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.575 HG12 ' HA2' ' A' ' 89' ' ' GLY . 58.0 mt -140.8 132.61 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-N 116.956 -0.111 . . . . 44.100000000000001 110.916 -179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 49.58 -129.0 25.09 Favored Glycine 0 CA--C 1.52 0.381 0 O-C-N 123.587 0.554 . . . . 72.019999999999996 114.281 172.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 13.0 m-20 -71.96 -23.65 61.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.864 0.364 . . . . 72.340000000000003 110.813 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.412 ' O ' ' HB3' ' A' ' 115' ' ' LYS . 58.6 t -62.11 -43.53 97.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 110.31 177.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.57 ' HB2' ' HB3' ' A' ' 108' ' ' LEU . 0.7 OUTLIER -70.18 -34.52 73.07 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.087 -0.645 . . . . 73.329999999999998 111.424 -176.984 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -72.47 -18.37 61.69 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.327 -0.549 . . . . 64.420000000000002 110.134 -178.539 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 112' ' ' VAL . 18.9 ttmm -68.29 -55.1 13.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.947 -0.569 . . . . 64.329999999999998 110.2 174.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 116' ' ' LEU . 3.9 mm? -67.18 -33.07 74.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.213 -0.448 . . . . 51.119999999999997 110.822 -179.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.933 ' HB3' ' HB3' ' A' ' 31' ' ' GLU . 72.8 mt-30 -72.7 -31.74 65.23 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.026 -0.534 . . . . 74.030000000000001 111.25 178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -57.82 -41.23 81.81 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 109.414 -0.587 . . . . 74.540000000000006 109.414 172.795 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -73.04 -17.59 61.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.562 -0.745 . . . . 72.030000000000001 110.95 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.9 -67.21 0.81 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.168 -0.469 . . . . 64.439999999999998 110.896 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 37.1 mt-10 -98.25 115.5 28.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.123 0.487 . . . . 73.319999999999993 110.768 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.391 -0.814 . . . . 61.310000000000002 109.865 178.901 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.982 0.42 . . . . 64.120000000000005 111.504 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.427 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.4 pm0 -88.27 121.08 30.25 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.154 -0.684 . . . . 71.239999999999995 109.154 172.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.415 ' OE1' ' HB2' ' A' ' 5' ' ' LYS . 1.1 tm-20 -127.12 137.1 52.92 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.105 -0.498 . . . . 75.439999999999998 109.746 -172.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.7 ttt -66.7 -37.14 84.12 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.518 0.562 . . . . 74.109999999999999 112.518 -169.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.415 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 75.4 mmtt -57.03 -37.2 71.42 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.556 0.217 . . . . 73.209999999999994 110.864 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttp180 -68.96 -35.24 76.52 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.912 0.386 . . . . 65.219999999999999 110.931 -177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.3 mp -68.56 -27.05 65.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.224 0.535 . . . . 73.209999999999994 110.294 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.9 mt -82.4 -37.99 24.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.726 -0.67 . . . . 75.230000000000004 110.216 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.75 -33.09 70.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.952 -0.567 . . . . 70.400000000000006 111.324 179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -54.73 116.47 2.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.454 . . . . 72.340000000000003 110.738 178.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.7 m -117.68 -166.29 1.18 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.966 -0.561 . . . . 52.549999999999997 110.786 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -89.9 128.72 36.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.801 0.334 . . . . 74.540000000000006 110.65 -177.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.59 96.0 4.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.902 -0.59 . . . . 71.450000000000003 109.982 -178.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -151.89 130.84 12.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.832 -0.622 . . . . 73.140000000000001 109.634 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 mptm? -69.21 102.22 1.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.906 0.384 . . . . 72.219999999999999 111.903 -178.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.529 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 63.3 t80 -94.28 -52.34 0.25 Allowed Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.308 -0.627 . . . . 74.349999999999994 109.308 169.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.529 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 59.1 Cg_endo -73.66 133.39 18.66 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.497 1.465 . . . . 75.340000000000003 110.808 169.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.74 98.57 8.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.281 0.562 . . . . 74.129999999999995 111.818 -176.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.789 HG21 ' HB2' ' A' ' 24' ' ' GLU . 75.9 t -136.75 128.79 17.06 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.311 -0.859 . . . . 72.109999999999999 109.266 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -45.34 -61.54 0.58 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.773 2.982 . . . . 71.530000000000001 114.316 -175.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.639 ' HB ' ' OD1' ' A' ' 97' ' ' ASP . 4.2 m -85.68 -98.26 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 120.806 -0.358 . . . . 70.510000000000005 111.798 -174.049 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.441 ' HG3' ' HA ' ' A' ' 42' ' ' GLU . 31.7 mmtp -147.59 -4.89 0.5 Allowed 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.112 -0.367 . . . . 75.420000000000002 111.87 -175.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.678 ' HB2' ' HB2' ' A' ' 97' ' ' ASP . 15.1 m -96.64 90.82 5.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.276 0.56 . . . . 72.430000000000007 112.347 -164.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.789 ' HB2' HG21 ' A' ' 19' ' ' VAL . 6.8 tp10 -163.51 157.66 19.92 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.963 -1.017 . . . . 44.229999999999997 109.201 171.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.476 ' HB2' ' OG ' ' A' ' 104' ' ' SER . 1.7 tm? -91.81 136.44 33.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.038 -0.528 . . . . 72.019999999999996 111.119 -174.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.437 ' N ' HD13 ' A' ' 25' ' ' LEU . . . -115.87 126.05 53.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 73.239999999999995 109.87 175.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.2 t -105.74 120.32 56.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.884 0.373 . . . . 70.420000000000002 110.867 -177.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.53 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 77.0 mm-40 -113.27 126.12 55.06 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.966 -0.753 . . . . 53.350000000000001 108.966 176.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.597 ' HB ' ' CB ' ' A' ' 120' ' ' ALA . 4.7 mp -116.04 134.82 58.19 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 C-N-CA 120.316 -0.554 . . . . 71.329999999999998 111.405 -174.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 121' ' ' GLU . 96.1 mt -120.36 103.74 9.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.773 -0.825 . . . . 71.319999999999993 108.773 171.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.651 ' OE2' ' HG3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -71.9 -12.29 61.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.936 0.398 . . . . 74.450000000000003 111.291 -173.104 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.651 ' HG3' ' OE2' ' A' ' 31' ' ' GLU . 28.8 mtmm -81.88 0.01 41.6 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.945 -0.57 . . . . 65.030000000000001 111.328 175.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -174.36 -105.51 0.19 Allowed Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.85 -1.167 . . . . 71.400000000000006 114.319 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -89.95 -179.19 5.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.496 0.665 . . . . 62.450000000000003 112.046 -167.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -117.9 127.74 75.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.388 -0.824 . . . . 73.219999999999999 109.062 171.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.53 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 22.7 ttp180 -97.79 110.12 22.75 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.606 0.717 . . . . 74.030000000000001 110.213 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -116.1 120.4 38.92 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.871 -1.059 . . . . 72.230000000000004 109.268 -176.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.414 ' HE1' ' HG2' ' A' ' 28' ' ' GLU . 33.1 p-90 -149.15 144.58 26.7 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.264 0.554 . . . . 75.349999999999994 111.203 -178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.479 ' HG3' ' HB ' ' A' ' 76' ' ' ILE . 17.9 ptm -128.27 158.86 37.0 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.601 -0.727 . . . . 62.420000000000002 109.524 174.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -124.41 129.91 51.53 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.073 -0.512 . . . . 75.530000000000001 109.731 177.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -93.99 150.41 20.37 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.0 -0.741 . . . . 73.209999999999994 109.0 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.441 ' HA ' ' HG3' ' A' ' 22' ' ' LYS . 0.1 OUTLIER -61.21 -41.16 96.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.875 0.369 . . . . 72.230000000000004 110.183 179.39 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.481 ' NZ ' ' HB2' ' A' ' 43' ' ' LYS . 9.9 mtmp? -151.42 -177.09 5.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.256 -1.387 . . . . 75.230000000000004 107.256 171.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.6 pp -107.42 -8.57 16.24 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.83 -0.748 . . . . 74.409999999999997 110.987 -176.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 40.2 t -114.57 106.3 14.1 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.458 -0.571 . . . . 75.319999999999993 109.458 171.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.5 m -172.85 -176.58 1.47 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.769 0.427 . . . . 75.129999999999995 110.5 -175.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -90.42 10.69 24.16 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.779 -0.646 . . . . 54.340000000000003 109.92 174.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.41 94.83 1.68 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.706 -0.679 . . . . 70.120000000000005 110.785 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -94.06 135.12 35.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.230000000000004 110.331 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 p -113.01 106.87 21.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.397 0.617 . . . . 61.229999999999997 110.024 177.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 m -88.21 127.47 35.45 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.967 -0.56 . . . . 60.109999999999999 110.857 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.444 ' HD1' ' HE2' ' A' ' 93' ' ' PHE . 62.8 m-85 -92.42 91.53 7.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.995 -0.548 . . . . 75.140000000000001 110.431 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 92' ' ' THR . 1.8 mp -109.69 117.2 54.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.603 0.716 . . . . 65.430000000000007 111.222 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.593 ' HB2' HD13 ' A' ' 59' ' ' ILE . 59.6 t80 -114.95 106.08 13.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.018 -0.992 . . . . 71.430000000000007 109.166 173.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 56.31 37.43 28.82 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.567 0.699 . . . . 64.129999999999995 109.805 -176.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.504 ' HA ' HG23 ' A' ' 53' ' ' ILE . 46.9 mt-10 70.51 21.18 5.63 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.082 -0.963 . . . . 63.25 112.171 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 36.3 mttm -115.79 128.9 56.19 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.464 -0.569 . . . . 71.439999999999998 109.464 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -74.03 117.59 16.0 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.788 -0.449 . . . . 71.319999999999993 109.788 178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.593 HD13 ' HB2' ' A' ' 54' ' ' PHE . 20.6 pt -109.57 164.59 5.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.296 0.57 . . . . 74.349999999999994 112.481 -171.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.05 161.88 34.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 114.971 -1.013 . . . . 73.219999999999999 109.212 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HG3' ' O ' ' A' ' 65' ' ' TYR . 41.2 tt0 -55.65 145.34 23.92 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 123.17 0.294 . . . . 71.239999999999995 110.604 178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.446 ' HA3' ' HD3' ' A' ' 63' ' ' PRO . . . -168.64 -126.1 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.462 -0.875 . . . . 75.329999999999998 112.977 -176.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.446 ' HD3' ' HA3' ' A' ' 62' ' ' GLY . 25.4 Cg_exo -62.7 -63.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.2 2.6 . . . . 74.150000000000006 113.52 -174.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.419 ' HB3' HD12 ' A' ' 83' ' ' LEU . 63.2 pttt -102.3 -3.16 27.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.819 0.342 . . . . 74.099999999999994 110.57 -177.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 98.0 m-85 -95.37 129.31 42.56 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.209 -0.451 . . . . 72.219999999999999 110.15 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.613 ' O ' ' HA ' ' A' ' 78' ' ' MET . 43.9 tptt -139.06 116.75 11.44 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.082 -1.081 . . . . 74.400000000000006 108.082 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 17.7 ptp -131.9 128.68 39.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.223 0.535 . . . . 64.340000000000003 111.478 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.85 147.53 47.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.107 -0.497 . . . . 73.209999999999994 110.256 179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 9.5 tt -108.71 117.19 53.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-O 121.111 0.481 . . . . 75.019999999999996 109.901 176.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.408 ' HB3' ' H ' ' A' ' 75' ' ' ILE . 28.8 t70 -86.49 118.1 25.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.965 0.412 . . . . 75.5 110.686 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -91.39 8.41 36.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.765 -0.652 . . . . 74.040000000000006 111.165 -177.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -91.9 -58.28 2.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.05 0.452 . . . . 70.010000000000005 110.246 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.44 ' HB ' HG12 ' A' ' 75' ' ' ILE . 2.2 m -109.22 -26.93 9.83 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.627 -0.715 . . . . 64.519999999999996 111.234 -173.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 103.76 34.16 3.88 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.751 -0.738 . . . . 44.509999999999998 111.405 -174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.44 HG12 ' HB ' ' A' ' 73' ' ' THR . 50.3 mm -89.36 131.04 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.76 0.314 . . . . 74.099999999999994 110.428 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HB ' ' HG3' ' A' ' 39' ' ' MET . 65.6 mt -125.28 110.75 25.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.044 -0.725 . . . . 71.420000000000002 109.044 176.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.84 167.58 13.35 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.461 0.648 . . . . 73.409999999999997 111.873 -175.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.613 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 58.8 ttp -150.36 118.03 6.17 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.004 -0.998 . . . . 62.32 109.149 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -108.77 113.41 26.34 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 109.487 -0.56 . . . . 54.340000000000003 109.487 -176.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 72.5 mtm -107.78 138.62 43.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.752 -0.658 . . . . 73.450000000000003 111.709 -172.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.31 163.14 17.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.715 -1.13 . . . . 74.010000000000005 109.878 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -93.41 127.18 38.92 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.109 -0.7 . . . . 70.140000000000001 109.109 173.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.419 HD12 ' HB3' ' A' ' 64' ' ' LYS . 95.2 mt -134.65 -74.25 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.869 0.366 . . . . 71.540000000000006 111.918 -174.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -132.9 161.46 34.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.37 -0.377 . . . . 74.140000000000001 111.416 -169.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.97 -63.44 1.31 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 112.522 0.564 . . . . 64.340000000000003 112.522 -170.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -77.62 -1.13 29.34 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.149 0.5 . . . . 74.140000000000001 111.0 -174.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -96.88 -0.33 47.9 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.764 -0.653 . . . . 54.229999999999997 109.613 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -101.11 135.99 41.67 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.502 -1.295 . . . . 64.340000000000003 107.502 169.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.578 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -142.45 -170.15 12.56 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 119.609 -1.281 . . . . 70.319999999999993 114.201 -170.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 7.9 m -86.0 117.33 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.442 -0.379 . . . . 65.340000000000003 110.569 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.449 ' HB3' ' HE1' ' A' ' 93' ' ' PHE . 85.5 m-85 -95.58 133.57 39.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.363 -0.38 . . . . 74.109999999999999 110.006 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.628 ' HA ' ' O ' ' A' ' 104' ' ' SER . 85.2 m -141.82 106.54 4.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.295 0.569 . . . . 74.239999999999995 110.191 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.484 ' HB2' ' HB2' ' A' ' 104' ' ' SER . 44.2 m-85 -107.41 152.1 24.64 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.627 -0.715 . . . . 70.219999999999999 110.018 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -132.01 116.97 17.78 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.363 -0.606 . . . . 75.329999999999998 109.363 -179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 mt -113.63 123.27 69.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.164 -0.471 . . . . 65.409999999999997 110.064 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -84.44 118.5 24.31 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.805 0.336 . . . . 74.420000000000002 110.296 -179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.678 ' HB2' ' HB2' ' A' ' 23' ' ' SER . 23.9 t70 -108.87 77.88 1.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.498 -0.556 . . . . 63.299999999999997 109.498 -177.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 66.35 -94.56 0.23 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.803 -0.713 . . . . 71.010000000000005 111.888 -177.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' A' ' 99' ' ' LYS . 0.3 OUTLIER -112.79 -0.66 14.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.983 0.421 . . . . 61.509999999999998 110.304 176.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -104.02 167.81 9.53 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.91 -0.586 . . . . 72.040000000000006 109.996 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 19.3 p -130.27 114.7 15.97 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.549 -0.296 . . . . 73.319999999999993 111.116 178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.85 144.93 30.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 110.215 -1.154 . . . . 73.040000000000006 110.215 173.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.37 128.41 44.48 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.373 0.606 . . . . 71.219999999999999 111.058 -173.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.628 ' O ' ' HA ' ' A' ' 92' ' ' THR . 3.8 m -126.2 98.39 5.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.913 -0.585 . . . . 75.340000000000003 110.747 -174.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 29.2 m -115.86 118.0 31.75 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.769 0.319 . . . . 63.299999999999997 110.163 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -144.01 114.21 7.41 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.21 -0.663 . . . . 73.230000000000004 109.21 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 4.3 p -98.53 115.85 39.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.206 0.527 . . . . 73.120000000000005 111.424 -177.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.525 HD22 ' HB2' ' A' ' 113' ' ' TYR . 85.8 mt -120.87 103.0 8.73 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.926 -0.579 . . . . 73.049999999999997 109.487 174.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.578 HG12 ' HA2' ' A' ' 89' ' ' GLY . 61.0 mt -147.91 126.09 3.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 119.426 -0.321 . . . . 64.530000000000001 110.226 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 38.92 -108.5 0.08 OUTLIER Glycine 0 N--CA 1.463 0.495 0 O-C-N 124.125 0.891 . . . . 72.219999999999999 114.883 173.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.632 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 15.0 t70 -73.25 -36.07 66.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.012 0.434 . . . . 73.420000000000002 111.007 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.6 t -62.38 -37.18 78.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.715 -0.675 . . . . 72.109999999999999 111.909 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.525 ' HB2' HD22 ' A' ' 108' ' ' LEU . 1.8 p90 -72.18 -23.74 61.32 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.21 -0.596 . . . . 73.109999999999999 111.382 -174.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 111' ' ' ASP . 19.0 pttm -70.03 -22.21 63.12 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.513 -0.475 . . . . 74.349999999999994 109.893 -178.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 119' ' ' GLU . 26.2 ttpp -61.92 -49.34 76.53 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.247 -0.649 . . . . 53.539999999999999 109.247 175.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -62.67 -32.27 73.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.6 -0.727 . . . . 72.239999999999995 110.396 178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.574 ' N ' HE21 ' A' ' 117' ' ' GLN . 0.0 OUTLIER -67.05 -44.0 81.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.126 -0.488 . . . . 50.399999999999999 110.643 178.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -69.23 -32.89 72.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 63.149999999999999 111.266 179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 115' ' ' LYS . 45.2 mt-10 -74.2 -20.09 60.31 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.474 -0.33 . . . . 74.420000000000002 111.378 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.597 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -85.76 -64.87 1.08 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.956 0.408 . . . . 65.329999999999998 111.018 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.516 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 40.4 mt-10 -115.3 98.37 6.72 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.364 -0.38 . . . . 63.009999999999998 110.592 178.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 71.8 t80 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.246 -0.883 . . . . 74.319999999999993 109.182 176.197 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 N--CA 1.48 1.056 0 N-CA-C 110.115 -0.328 . . . . 72.340000000000003 110.115 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -127.72 122.27 32.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.437 178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -110.27 175.34 5.47 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.759 -0.655 . . . . 63.350000000000001 109.788 176.722 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.4 ttt -64.78 -29.9 70.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.963 0.411 . . . . 74.140000000000001 110.719 -177.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -64.3 -28.19 69.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.072 -0.513 . . . . 74.310000000000002 110.887 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 38.1 ttt180 -63.41 -36.01 82.31 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-O 120.885 0.374 . . . . 74.409999999999997 110.252 176.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.9 mp -70.49 -27.3 64.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 64.219999999999999 110.249 179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.1 mp -78.04 -15.12 59.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.04 -0.527 . . . . 63.219999999999999 110.182 175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -90.34 -46.01 8.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 72.25 110.838 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.63 ' HA ' ' HG3' ' A' ' 77' ' ' GLU . 2.6 mm? -47.3 109.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.654 0.596 . . . . 75.310000000000002 111.794 -178.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.4 t -100.94 -173.87 2.48 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.722 -0.672 . . . . 61.549999999999997 110.847 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -87.61 105.42 17.33 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.045 -0.724 . . . . 63.43 109.045 177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.416 ' HA ' ' CZ3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -88.86 14.39 10.47 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.886 0.374 . . . . 64.140000000000001 111.613 -171.495 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -94.95 106.87 18.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.025 0.441 . . . . 71.409999999999997 111.35 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 38' ' ' TRP . 8.6 mmmm -91.27 157.4 17.17 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.79 -0.641 . . . . 75.329999999999998 110.064 173.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.496 ' H ' ' HD2' ' A' ' 17' ' ' PRO . 51.5 m-85 -96.73 -52.48 0.22 Allowed Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 110.008 -0.367 . . . . 74.420000000000002 110.008 168.269 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.496 ' HD2' ' H ' ' A' ' 16' ' ' PHE . 53.4 Cg_endo -73.57 75.8 2.93 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 121.361 1.374 . . . . 72.109999999999999 110.427 167.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.8 p -79.05 161.0 26.88 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.4 -0.818 . . . . 74.230000000000004 112.264 -173.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 6.0 m -108.05 147.36 35.37 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.558 -0.746 . . . . 75.400000000000006 110.144 173.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -56.31 -65.43 0.11 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.092 2.528 . . . . 62.119999999999997 112.128 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.6 m -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.508 -0.923 . . . . 61.0 108.508 171.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 41' ' ' ALA . 71.6 mmtt -106.5 104.7 14.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.047 0.927 . . . . 64.030000000000001 110.64 -177.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.6 t -153.15 34.45 0.47 Allowed 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 113.527 -1.669 . . . . 74.439999999999998 106.601 179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.427 ' HB3' ' HB3' ' A' ' 40' ' ' GLN . 9.6 tp10 -68.62 109.11 3.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 113.495 -1.684 . . . . 71.120000000000005 111.214 -172.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.616 HD21 ' HZ ' ' A' ' 37' ' ' PHE . 1.3 tm? -107.7 119.31 39.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.063 -0.517 . . . . 73.140000000000001 109.824 178.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.485 ' HB3' ' CE2' ' A' ' 38' ' ' TRP . . . -143.99 165.68 27.1 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.83 0.347 . . . . 74.409999999999997 110.827 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.7 p -143.29 128.61 15.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.023 -0.535 . . . . 75.549999999999997 110.717 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 36' ' ' ARG . 16.5 mm-40 -110.7 122.21 47.23 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.168 -0.679 . . . . 71.040000000000006 109.168 -178.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 29' ' ' ILE . 4.2 mp -98.96 123.97 51.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 122.062 -0.399 . . . . 72.409999999999997 110.831 -176.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -100.41 128.23 46.52 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.001 -0.74 . . . . 75.129999999999995 109.001 174.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' O ' ' A' ' 117' ' ' GLN . 0.4 OUTLIER -70.84 5.95 1.73 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.044 0.45 . . . . 63.340000000000003 112.113 -174.02 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -75.48 -17.65 60.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.189 -0.459 . . . . 73.340000000000003 110.395 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.55 28.06 6.17 Favored Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 111.172 -0.771 . . . . 64.129999999999995 111.172 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.42 HE22 ' HB3' ' A' ' 81' ' ' GLU . 44.2 tp60 -143.41 127.9 17.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.807 -0.812 . . . . 73.150000000000006 108.807 -177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.43 ' CG1' ' HB2' ' A' ' 80' ' ' MET . 11.3 p -99.86 137.32 27.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.107 0.48 . . . . 73.140000000000001 111.517 -175.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.488 ' HB3' ' HB2' ' A' ' 28' ' ' GLU . 7.5 tpp180 -104.24 117.56 34.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.557 -0.747 . . . . 75.540000000000006 109.69 178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.616 ' HZ ' HD21 ' A' ' 25' ' ' LEU . 60.7 t80 -122.03 135.62 54.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 121.121 -0.232 . . . . 72.549999999999997 110.685 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.485 ' CE2' ' HB3' ' A' ' 26' ' ' ALA . 41.2 p-90 -144.09 152.87 41.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.096 -0.502 . . . . 73.319999999999993 110.898 -179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.502 ' HG2' ' O ' ' A' ' 76' ' ' ILE . 21.3 ptp -145.76 130.01 17.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.106 0.479 . . . . 52.409999999999997 110.383 174.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 24' ' ' GLU . 35.2 tt0 -107.43 105.49 15.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.821 -0.627 . . . . 61.520000000000003 110.367 -178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HA ' ' O ' ' A' ' 22' ' ' LYS . . . -116.21 148.7 40.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.227 -0.442 . . . . 74.150000000000006 109.901 177.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -105.29 5.83 32.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 75.450000000000003 110.678 178.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.437 ' HG3' ' OE2' ' A' ' 42' ' ' GLU . 64.5 mttp -116.39 133.02 56.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.704 -0.68 . . . . 73.319999999999993 110.053 177.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' N ' HD13 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -125.27 -26.44 3.63 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.923 0.392 . . . . 72.510000000000005 110.429 174.065 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.477 ' N ' HD22 ' A' ' 44' ' ' LEU . 51.5 m -117.34 109.46 16.85 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.801 -0.444 . . . . 72.239999999999995 109.801 170.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 43.1 p 174.75 -169.62 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.485 -0.561 . . . . 60.509999999999998 109.485 -178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -94.04 16.52 14.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.873 0.368 . . . . 64.129999999999995 110.597 174.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.572 ' HA ' ' O ' ' A' ' 96' ' ' GLN . . . -76.3 87.59 3.11 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.096 0.474 . . . . 70.450000000000003 110.437 177.754 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -95.79 137.3 35.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.021 -0.536 . . . . 74.25 110.578 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.5 p -101.19 116.86 45.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.681 -0.691 . . . . 54.539999999999999 109.869 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.1 m -81.91 106.25 13.68 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.849 -0.614 . . . . 74.519999999999996 110.636 -177.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.4 ' O ' HG13 ' A' ' 59' ' ' ILE . 75.2 m-85 -81.99 95.32 7.37 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.814 -0.81 . . . . 75.349999999999994 108.814 173.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.46 ' HB ' ' O ' ' A' ' 92' ' ' THR . 45.6 mm -107.35 126.06 63.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.038 -0.528 . . . . 73.25 111.79 -173.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -127.99 108.93 11.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.626 -0.715 . . . . 74.150000000000006 109.164 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 61.03 31.53 19.87 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.918 0.866 . . . . 71.450000000000003 109.613 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HA ' HG23 ' A' ' 53' ' ' ILE . 50.3 mt-10 69.75 16.32 7.89 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 114.856 -1.065 . . . . 63.310000000000002 111.46 -178.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -107.59 166.33 10.76 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.05 -1.092 . . . . 71.530000000000001 108.05 171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -88.19 145.42 25.91 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.403 -0.592 . . . . 63.130000000000003 109.403 174.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 52' ' ' TYR . 0.1 OUTLIER -108.37 150.44 11.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 120.949 0.404 . . . . 64.040000000000006 111.029 -176.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -120.62 160.41 23.3 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.783 -0.644 . . . . 75.25 109.963 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 67' ' ' MET . 0.2 OUTLIER -82.51 144.86 30.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.418 -0.355 . . . . 75.010000000000005 110.319 -176.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -171.03 -146.22 5.12 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 121.048 -0.596 . . . . 71.030000000000001 112.028 -178.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -70.66 -45.0 1.21 Allowed 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.561 2.174 . . . . 72.340000000000003 112.109 178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.513 ' HG3' ' OD1' ' A' ' 87' ' ' ASP . 1.3 tmtp? -73.07 -53.4 11.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.913 -0.585 . . . . 43.450000000000003 109.893 -178.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 91' ' ' TYR . 34.5 m-85 -98.95 127.35 44.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 74.430000000000007 110.283 -177.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 62.1 mmtt -121.67 115.16 22.23 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.582 -0.525 . . . . 75.099999999999994 109.582 171.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.484 ' H ' ' HG3' ' A' ' 61' ' ' GLU . 57.7 mtm -127.84 110.27 12.42 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.344 -0.843 . . . . 73.120000000000005 108.768 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -106.13 114.44 28.58 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.184 -0.673 . . . . 72.299999999999997 109.184 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 33.9 pt -89.19 141.69 13.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.06 -0.518 . . . . 70.409999999999997 111.041 -176.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -115.82 133.32 56.15 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.426 177.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.411 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.2 mpp_? -110.36 3.9 20.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.991 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -88.81 -49.47 6.8 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.943 0.402 . . . . 72.010000000000005 110.305 -178.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -116.44 -37.37 3.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.233 -0.44 . . . . 73.0 111.531 -178.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 112.37 20.69 6.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.748 -0.739 . . . . 42.340000000000003 112.322 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 51.1 mm -96.19 108.32 21.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.972 0.415 . . . . 74.409999999999997 110.202 179.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' MET . 70.1 mt -116.38 112.88 41.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.075 -0.511 . . . . 63.420000000000002 110.361 -178.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.63 ' HG3' ' HA ' ' A' ' 10' ' ' LEU . 5.8 mm-40 -110.07 145.68 36.68 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.234 -0.439 . . . . 75.010000000000005 110.144 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.453 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 63.3 ttp -124.92 138.15 54.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.223 0.535 . . . . 75.129999999999995 111.073 179.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -125.72 120.28 30.23 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.961 -0.755 . . . . 75.310000000000002 108.961 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.43 ' HB2' ' CG1' ' A' ' 35' ' ' VAL . 61.1 mtm -122.4 139.43 53.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.139 0.495 . . . . 75.239999999999995 111.921 -176.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 10.4 pt-20 -141.99 127.61 19.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.976 -1.011 . . . . 75.519999999999996 108.682 173.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 87' ' ' ASP . 17.0 pttp -89.02 154.76 19.95 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.493 -0.483 . . . . 73.019999999999996 110.913 -175.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -115.69 -41.11 3.27 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.9 -0.591 . . . . 63.420000000000002 110.581 179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -100.43 179.26 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.936 -0.574 . . . . 54.109999999999999 112.1 -175.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.8 -46.67 18.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.489 -0.778 . . . . 73.150000000000006 109.662 173.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -75.95 5.71 6.16 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 114.944 -1.025 . . . . 72.129999999999995 110.565 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.513 ' OD1' ' HG3' ' A' ' 64' ' ' LYS . 5.1 t70 -70.32 -45.31 66.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.92 -1.036 . . . . 64.439999999999998 111.783 -171.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -87.49 141.49 28.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.813 -0.63 . . . . 73.319999999999993 109.996 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.504 ' HA2' HG12 ' A' ' 109' ' ' ILE . . . -153.82 -153.48 6.42 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.303 -0.951 . . . . 52.200000000000003 113.176 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 107' ' ' VAL . 18.1 m -85.21 114.7 22.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.577 0.227 . . . . 74.200000000000003 111.219 -178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.713 ' HE1' ' HE1' ' A' ' 65' ' ' TYR . 94.8 m-85 -103.39 139.97 38.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.343 -0.389 . . . . 74.109999999999999 110.28 178.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . 0.46 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 89.9 m -143.17 121.42 12.25 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.385 -0.37 . . . . 71.430000000000007 110.362 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.481 ' O ' ' HA ' ' A' ' 103' ' ' HIS . 40.1 m-85 -116.15 122.43 45.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.436 -0.347 . . . . 74.340000000000003 110.563 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -131.4 119.84 22.23 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.241 -0.436 . . . . 70.109999999999999 110.204 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.461 ' N ' HD12 ' A' ' 95' ' ' ILE . 4.0 mp -103.94 125.03 58.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.16 -0.473 . . . . 75.120000000000005 109.899 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.572 ' O ' ' HA ' ' A' ' 48' ' ' ALA . 35.5 tt0 -90.82 106.9 18.83 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.125 -0.489 . . . . 74.140000000000001 110.413 178.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.516 ' HB3' ' O ' ' A' ' 100' ' ' ALA . 18.9 t70 -109.23 157.84 18.42 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.554 -0.535 . . . . 64.439999999999998 109.554 175.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -61.22 -26.6 66.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.372 -0.442 . . . . 61.210000000000001 113.336 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.7 mttp -131.5 -38.97 1.15 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.899 0.349 . . . . 71.120000000000005 111.496 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 97' ' ' ASP . . . -91.79 165.04 13.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.939 0.4 . . . . 65.420000000000002 110.752 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 14.0 m -145.22 114.6 7.12 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.784 0.326 . . . . 74.010000000000005 110.145 175.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -106.44 123.17 7.3 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.398 -0.906 . . . . 71.230000000000004 111.562 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.481 ' HA ' ' O ' ' A' ' 93' ' ' PHE . 7.4 p80 -140.37 133.49 29.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.975 0.417 . . . . 72.349999999999994 110.655 178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.6 t -134.31 123.2 23.79 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.778 -0.646 . . . . 73.150000000000006 109.8 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m -102.53 119.03 38.12 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 109.715 178.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.408 ' HG ' ' HG ' ' A' ' 108' ' ' LEU . 60.5 tp -133.81 100.22 4.69 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.971 0.415 . . . . 63.340000000000003 110.669 -176.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' THR . 3.4 p -95.26 107.21 19.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.404 0.621 . . . . 54.039999999999999 110.331 178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.553 HD22 ' HA ' ' A' ' 113' ' ' TYR . 89.8 mt -111.67 104.08 12.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.171 -0.468 . . . . 61.310000000000002 109.875 179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.504 HG12 ' HA2' ' A' ' 89' ' ' GLY . 65.1 mt -141.85 125.38 15.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.569 -0.53 . . . . 72.230000000000004 109.569 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 46.04 -107.39 0.18 Allowed Glycine 0 CA--C 1.52 0.346 0 O-C-N 124.129 0.893 . . . . 63.100000000000001 113.649 176.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.637 ' O ' ' HG3' ' A' ' 114' ' ' LYS . 18.7 t70 -69.7 -36.97 76.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.96 0.41 . . . . 70.510000000000005 111.383 -175.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 11.9 t -66.16 -34.0 67.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.31 0.576 . . . . 64.540000000000006 109.867 -178.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.553 ' HA ' HD22 ' A' ' 108' ' ' LEU . 42.7 t80 -73.27 -31.95 64.37 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.783 -0.644 . . . . 65.030000000000001 111.265 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.637 ' HG3' ' O ' ' A' ' 111' ' ' ASP . 0.0 OUTLIER -76.08 -25.03 55.11 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.678 -0.49 . . . . 64.019999999999996 109.678 177.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -59.46 -52.97 63.3 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 115.626 -0.716 . . . . 73.549999999999997 111.128 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.417 ' HB3' HG12 ' A' ' 29' ' ' ILE . 4.4 mm? -60.28 -31.35 70.15 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.818 -0.628 . . . . 74.340000000000003 111.699 -178.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.409 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 79.2 mm-40 -54.14 -55.79 24.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.489 -0.323 . . . . 73.549999999999997 111.765 -176.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.85 -21.57 23.63 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.728 0.64 . . . . 74.219999999999999 112.728 -171.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -85.31 -10.84 55.92 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.555 -0.458 . . . . 70.310000000000002 111.237 178.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.416 ' CB ' ' HB ' ' A' ' 29' ' ' ILE . . . -95.13 -59.96 1.78 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.394 -0.595 . . . . 34.0 109.394 171.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -108.69 121.27 44.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 70.25 110.058 175.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . . . . . . . . . 91.8 m-85 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.117 -0.945 . . . . 75.430000000000007 110.289 -177.942 . . . . . . . . 0 0 . 1 stop_ save_