data_2lr2_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 2lr2 _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 ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' HA ' ' OG ' ' A' ' 71' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.765 0.317 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.672 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.486 HG21 ' HG3' ' A' ' 65' ' ' GLU . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.563 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.672 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.4 t-20 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 96.8 p . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.767 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.507 HE22 HD13 ' A' ' 47' ' ' LEU . 12.7 tp60 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.469 ' HB2' HE21 ' A' ' 22' ' ' GLN . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HD11 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo . . . . . 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.765 0.317 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.98 ' O ' HD21 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.98 HD21 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.475 ' HZ3' ' HB3' ' A' ' 61' ' ' TYR . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.675 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.479 HG21 ' HG3' ' A' ' 65' ' ' GLU . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.564 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.675 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.3 t-20 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.475 ' HB3' ' HZ3' ' A' ' 48' ' ' LYS . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 86.0 p . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD12 ' HG2' ' A' ' 28' ' ' GLU . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 52.5 t -122.68 131.77 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 C-N-CA 123.581 0.752 . . . . 0.0 109.054 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -70.62 143.21 51.54 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.012 0.925 . . . . 0.0 110.27 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -100.35 142.97 31.1 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.428 1.091 . . . . 0.0 110.817 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -106.59 153.05 22.91 Favored 'General case' 0 N--CA 1.501 2.119 0 C-N-CA 125.421 1.488 . . . . 0.0 110.726 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.99 120.97 14.53 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 174.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.838 ' OE1' ' O ' ' A' ' 69' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -69.91 157.49 59.92 Favored 'Trans proline' 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 59.1 58.21 3.21 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.3 mt -63.41 136.05 57.36 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -173.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.4 t-20 -116.33 118.78 33.7 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 100.202 -3.999 . . . . 0.0 100.202 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.0 -46.82 67.05 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.581 -171.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.563 ' HA ' ' OG ' ' A' ' 69' ' ' SER . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.672 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.486 HG21 ' HG3' ' A' ' 65' ' ' GLU . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.563 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.672 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.4 t-20 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t -84.63 172.4 11.62 Favored 'General case' 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.35 66.8 0.18 Allowed Glycine 2 N--CA 1.533 5.11 0 CA-C-N 119.939 1.245 . . . . 0.0 112.506 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.838 ' O ' ' OE1' ' A' ' 22' ' ' GLN . 49.9 p -157.22 167.8 29.28 Favored 'General case' 0 C--O 1.198 -1.647 0 C-N-CA 123.621 0.769 . . . . 0.0 110.511 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -58.05 51.71 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.629 0 C-N-CA 125.881 1.672 . . . . 0.0 109.715 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.498 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 96.8 p -56.94 -25.3 57.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 -171.377 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.767 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.3 t -122.89 131.76 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -75.56 149.38 38.34 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.131 0.972 . . . . 0.0 110.502 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -94.54 105.02 16.97 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.027 0.931 . . . . 0.0 110.438 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -63.63 -44.61 93.39 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.058 0.943 . . . . 0.0 112.627 -177.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 -176.34 99.96 0.06 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.507 HE22 HD13 ' A' ' 47' ' ' LEU . 12.7 tp60 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.469 ' HB2' HE21 ' A' ' 22' ' ' GLN . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.585 ' O ' HD11 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.585 HD11 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo -71.8 154.65 58.8 Favored 'Trans proline' 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 58.37 36.68 25.65 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.56 0.695 . . . . 0.0 109.661 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 39.6 tp -100.73 129.8 46.68 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.944 -177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.73 138.3 56.14 Favored 'General case' 0 CA--C 1.562 1.413 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -58.3 -46.84 85.35 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 127.619 2.368 . . . . 0.0 110.586 178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.98 ' O ' HD21 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.98 HD21 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.475 ' HZ3' ' HB3' ' A' ' 61' ' ' TYR . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.675 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.479 HG21 ' HG3' ' A' ' 65' ' ' GLU . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.564 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.675 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.3 t-20 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.475 ' HB3' ' HZ3' ' A' ' 48' ' ' LYS . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m -85.88 153.34 22.3 Favored 'General case' 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -108.59 -132.54 6.68 Favored Glycine 2 N--CA 1.528 4.796 0 O-C-N 120.955 -1.091 . . . . 0.0 113.967 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.464 ' C ' ' H ' ' A' ' 71' ' ' SER . 83.3 p -149.45 -50.78 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.551 0.741 . . . . 0.0 111.052 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -73.14 33.96 0.07 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 124.31 1.044 . . . . 0.0 110.406 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.496 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 86.0 p -63.97 -30.36 71.44 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD12 ' HG2' ' A' ' 28' ' ' GLU . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.499 ' HA ' ' OG ' ' A' ' 71' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.625 ' O ' HD12 ' A' ' 29' ' ' ILE . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.765 0.317 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 74' ' ' LEU . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 47' ' ' LEU . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.421 HD11 HD13 ' A' ' 29' ' ' ILE . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 53' ' ' ILE . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.707 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.409 ' OD1' ' OE2' ' A' ' 65' ' ' GLU . 3.3 m-20 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.707 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 12.3 t30 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.495 ' N ' HD13 ' A' ' 66' ' ' LEU . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 63' ' ' GLY 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.499 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 96.8 p . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.601 HD11 ' HB3' ' A' ' 43' ' ' PHE . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' A' ' 29' ' ' ILE . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.786 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 16.9 t-20 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.508 ' NE2' ' HB3' ' A' ' 71' ' ' SER . 1.2 tp-100 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 75' ' ' LEU . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.643 ' O ' HD13 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo . . . . . 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.765 0.317 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 1.132 ' O ' HD23 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 1.132 HD23 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HZ2' ' HA ' ' A' ' 66' ' ' LEU . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 53' ' ' ILE . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.706 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 55' ' ' THR . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.403 ' OD1' ' OE2' ' A' ' 65' ' ' GLU . 3.3 m-20 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.706 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 12.2 t30 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.46 ' O ' HD22 ' A' ' 66' ' ' LEU . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 63' ' ' GLY 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 5 4 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.508 ' HB3' ' NE2' ' A' ' 22' ' ' GLN . 86.0 p . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB3' HD21 ' A' ' 47' ' ' LEU . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 15.7 t-20 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 52.5 t -122.68 131.77 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 C-N-CA 123.581 0.752 . . . . 0.0 109.054 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -70.62 143.21 51.54 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.012 0.925 . . . . 0.0 110.27 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -100.35 142.97 31.1 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.428 1.091 . . . . 0.0 110.817 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -106.59 153.05 22.91 Favored 'General case' 0 N--CA 1.501 2.119 0 C-N-CA 125.421 1.488 . . . . 0.0 110.726 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.99 120.97 14.53 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 174.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.838 ' OE1' ' O ' ' A' ' 69' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.625 ' O ' HD12 ' A' ' 29' ' ' ILE . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -69.91 157.49 59.92 Favored 'Trans proline' 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 59.1 58.21 3.21 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.3 mt -63.41 136.05 57.36 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -173.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.4 t-20 -116.33 118.78 33.7 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 100.202 -3.999 . . . . 0.0 100.202 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.0 -46.82 67.05 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.581 -171.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 74' ' ' LEU . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 47' ' ' LEU . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.604 ' HA ' ' OG ' ' A' ' 69' ' ' SER . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.448 HG23 ' O ' ' A' ' 53' ' ' ILE . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.707 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.409 ' OD1' ' OE2' ' A' ' 65' ' ' GLU . 3.3 m-20 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.707 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 12.3 t30 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.495 ' N ' HD13 ' A' ' 66' ' ' LEU . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 63' ' ' GLY 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t -84.63 172.4 11.62 Favored 'General case' 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.35 66.8 0.18 Allowed Glycine 2 N--CA 1.533 5.11 0 CA-C-N 119.939 1.245 . . . . 0.0 112.506 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.838 ' O ' ' OE1' ' A' ' 22' ' ' GLN . 49.9 p -157.22 167.8 29.28 Favored 'General case' 0 C--O 1.198 -1.647 0 C-N-CA 123.621 0.769 . . . . 0.0 110.511 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -58.05 51.71 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.629 0 C-N-CA 125.881 1.672 . . . . 0.0 109.715 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' SER . 96.8 p -56.94 -25.3 57.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 -171.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.601 HD11 ' HB3' ' A' ' 43' ' ' PHE . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' A' ' 29' ' ' ILE . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.786 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 16.9 t-20 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.3 t -122.89 131.76 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -75.56 149.38 38.34 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.131 0.972 . . . . 0.0 110.502 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.409 HD21 ' ND2' ' A' ' 19' ' ' ASN . 62.1 t-20 -94.54 105.02 16.97 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.027 0.931 . . . . 0.0 110.438 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -63.63 -44.61 93.39 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.058 0.943 . . . . 0.0 112.627 -177.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 -176.34 99.96 0.06 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.409 ' ND2' HD21 ' A' ' 16' ' ' ASN . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.508 ' NE2' ' HB3' ' A' ' 71' ' ' SER . 1.2 tp-100 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 75' ' ' LEU . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.643 ' O ' HD13 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo -71.8 154.65 58.8 Favored 'Trans proline' 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 58.37 36.68 25.65 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.56 0.695 . . . . 0.0 109.661 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 32' ' ' LEU . 39.6 tp -100.73 129.8 46.68 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.944 -177.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.73 138.3 56.14 Favored 'General case' 0 CA--C 1.562 1.413 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -58.3 -46.84 85.35 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 127.619 2.368 . . . . 0.0 110.586 178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 1.132 ' O ' HD23 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.132 HD23 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HZ2' ' HA ' ' A' ' 66' ' ' LEU . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 53' ' ' ILE . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.706 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 55' ' ' THR . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.403 ' OD1' ' OE2' ' A' ' 65' ' ' GLU . 3.3 m-20 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.706 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 12.2 t30 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.46 ' O ' HD22 ' A' ' 66' ' ' LEU . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 63' ' ' GLY 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m -85.88 153.34 22.3 Favored 'General case' 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -108.59 -132.54 6.68 Favored Glycine 2 N--CA 1.528 4.796 0 O-C-N 120.955 -1.091 . . . . 0.0 113.967 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 71' ' ' SER . 83.3 p -149.45 -50.78 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.551 0.741 . . . . 0.0 111.052 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -73.14 33.96 0.07 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 124.31 1.044 . . . . 0.0 110.406 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.508 ' HB3' ' NE2' ' A' ' 22' ' ' GLN . 86.0 p -63.97 -30.36 71.44 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB3' HD21 ' A' ' 47' ' ' LEU . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 15.7 t-20 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.499 ' HA ' ' OG ' ' A' ' 71' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.625 ' O ' HD12 ' A' ' 29' ' ' ILE . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo . . . . . 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.765 0.317 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 74' ' ' LEU . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 47' ' ' LEU . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.421 HD11 HD13 ' A' ' 29' ' ' ILE . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.448 ' O ' HG23 ' A' ' 53' ' ' ILE . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.707 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.411 ' OG1' ' ND2' ' A' ' 56' ' ' ASN . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.563 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.707 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.4 t-20 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.495 ' N ' HD13 ' A' ' 66' ' ' LEU . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 63' ' ' GLY 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.499 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 96.8 p . . . . . 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.601 HD11 ' HB3' ' A' ' 43' ' ' PHE . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' A' ' 29' ' ' ILE . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.786 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 28.1 t30 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.794 HE22 HD12 ' A' ' 47' ' ' LEU . 12.7 tp60 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 75' ' ' LEU . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.516 ' HB2' HE21 ' A' ' 22' ' ' GLN . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.643 ' O ' HD13 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo . . . . . 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.765 0.317 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 1.132 ' O ' HD23 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 1.132 HD23 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HZ2' ' HA ' ' A' ' 66' ' ' LEU . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.455 ' O ' HG23 ' A' ' 53' ' ' ILE . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.706 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.413 ' OG1' ' ND2' ' A' ' 56' ' ' ASN . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.564 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.706 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.3 t-20 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.46 ' O ' HD22 ' A' ' 66' ' ' LEU . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 63' ' ' GLY 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.501 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 86.0 p . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB3' HD21 ' A' ' 47' ' ' LEU . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 38.7 t30 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.36 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 52.5 t -122.68 131.77 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 C-N-CA 123.581 0.752 . . . . 0.0 109.054 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -70.62 143.21 51.54 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.012 0.925 . . . . 0.0 110.27 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 98.4 m-20 -100.35 142.97 31.1 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.428 1.091 . . . . 0.0 110.817 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -106.59 153.05 22.91 Favored 'General case' 0 N--CA 1.501 2.119 0 C-N-CA 125.421 1.488 . . . . 0.0 110.726 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.99 120.97 14.53 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 103.011 -2.959 . . . . 0.0 103.011 174.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -93.52 -158.25 0.6 Allowed 'General case' 0 C--N 1.4 2.766 2 C-N-CA 107.624 -5.63 . . . . 0.0 110.595 -174.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -82.9 -49.29 9.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.565 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 83.6 tt0 -51.27 -29.03 13.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.519 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.838 ' OE1' ' O ' ' A' ' 69' ' ' SER . 32.6 mm-40 -81.66 -57.66 3.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.593 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.59 -39.4 16.63 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.564 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -59.79 -47.69 84.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.562 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.625 ' O ' HD12 ' A' ' 29' ' ' ILE . . . -69.0 -35.68 76.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.59 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.97 -37.7 71.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -70.44 -43.68 69.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.568 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -54.48 -44.16 72.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.563 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.631 HD11 ' HA ' ' A' ' 75' ' ' LEU . 1.4 mp -65.86 -29.03 45.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.566 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.94 -5.92 58.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.581 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -97.96 -1.48 42.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 29' ' ' ILE . 66.5 mt -58.38 115.44 11.48 Favored Pre-proline 0 CA--C 1.587 2.38 0 O-C-N 120.114 -1.616 . . . . 0.0 113.893 -177.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -69.91 157.49 59.92 Favored 'Trans proline' 0 N--CA 1.532 3.77 0 C-N-CA 122.34 2.027 . . . . 0.0 111.482 176.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 59.1 58.21 3.21 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -178.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 79.3 mt -63.41 136.05 57.36 Favored 'General case' 0 CA--C 1.554 1.111 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -173.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.4 t-20 -116.33 118.78 33.7 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 100.202 -3.999 . . . . 0.0 100.202 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.6 mp0 -69.0 -46.82 67.05 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.581 -171.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -54.7 -42.3 71.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.599 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -69.42 -52.85 23.0 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.582 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 71.5 ttp85 -47.37 -52.93 15.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.556 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.426 ' O ' ' C ' ' A' ' 42' ' ' ALA . 46.4 t30 -55.09 -66.48 0.4 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.562 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.63 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.601 ' HB3' HD11 ' A' ' 74' ' ' LEU . 6.1 m-30 -68.92 -46.08 69.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.575 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 47' ' ' LEU . 4.5 mt -60.6 -38.65 78.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.56 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.6 -53.68 50.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.582 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.4 m -49.92 -34.16 19.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.596 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.604 ' HA ' ' OG ' ' A' ' 69' ' ' SER . 86.5 mt -68.38 -11.98 60.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.575 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 87.5 tttt -105.33 -38.03 6.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -60.82 -13.94 18.6 Favored 'General case' 0 N--CA 1.509 2.523 0 N-CA-C 120.01 3.337 . . . . 0.0 120.01 -164.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -62.39 -42.91 99.79 Favored 'General case' 0 CA--C 1.595 2.708 0 N-CA-C 113.896 1.072 . . . . 0.0 113.896 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.4 p -155.16 159.66 40.32 Favored 'General case' 0 N--CA 1.538 3.955 0 CA-C-O 116.12 -1.895 . . . . 0.0 107.133 178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.64 131.36 43.12 Favored 'General case' 2 CA--C 1.657 5.073 0 N-CA-C 121.778 3.992 . . . . 0.0 121.778 -172.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.448 ' O ' HG23 ' A' ' 53' ' ' ILE . 18.3 tt -145.36 119.33 2.8 Favored 'Isoleucine or valine' 1 C--N 1.494 6.865 2 CA-C-N 129.223 5.465 . . . . 0.0 111.201 -171.808 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.707 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.14 67.72 2.48 Favored 'General case' 0 C--N 1.375 1.675 0 O-C-N 118.899 -2.375 . . . . 0.0 111.976 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.411 ' OG1' ' ND2' ' A' ' 56' ' ' ASN . 14.4 p -46.79 -44.01 18.8 Favored 'General case' 0 CA--C 1.494 -1.205 0 N-CA-C 119.102 3.001 . . . . 0.0 119.102 177.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.563 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.2 7.39 28.53 Favored 'General case' 0 N--CA 1.399 -2.983 0 CA-C-O 126.898 3.237 . . . . 0.0 119.669 -179.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.707 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.4 t-20 52.2 52.64 13.9 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 110.614 -2.994 . . . . 0.0 114.749 177.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.52 9.83 10.98 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 117.745 -1.582 . . . . 0.0 114.443 178.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.69 -4.76 85.05 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 116.521 -2.752 . . . . 0.0 117.761 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.3 158.98 40.46 Favored 'General case' 0 N--CA 1.409 -2.513 0 O-C-N 121.955 -0.732 . . . . 0.0 112.508 -177.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.08 117.21 33.54 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 100.651 -3.833 . . . . 0.0 100.651 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.951 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.59 170.48 20.71 Favored 'General case' 0 C--N 1.364 1.218 0 C-N-CA 117.305 -1.758 . . . . 0.0 113.116 -179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.495 ' N ' HD13 ' A' ' 66' ' ' LEU . . . 39.2 -119.42 0.99 Allowed Glycine 0 N--CA 1.428 -1.849 0 N-CA-C 119.538 2.575 . . . . 0.0 119.538 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.66 -8.18 9.43 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 116.954 -1.498 . . . . 0.0 112.179 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.951 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.27 -7.03 59.62 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 125.312 1.633 . . . . 0.0 110.194 177.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 ' N ' ' A' ' 63' ' ' GLY 0.301 9.6 mp -61.47 -41.96 98.04 Favored 'General case' 0 CA--C 1.624 3.799 0 N-CA-C 120.62 3.563 . . . . 0.0 120.62 -179.583 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 29.2 t -84.63 172.4 11.62 Favored 'General case' 1 N--CA 1.589 6.514 0 CA-C-N 125.603 3.82 . . . . 0.0 116.53 -173.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.35 66.8 0.18 Allowed Glycine 2 N--CA 1.533 5.11 0 CA-C-N 119.939 1.245 . . . . 0.0 112.506 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.838 ' O ' ' OE1' ' A' ' 22' ' ' GLN . 49.9 p -157.22 167.8 29.28 Favored 'General case' 0 C--O 1.198 -1.647 0 C-N-CA 123.621 0.769 . . . . 0.0 110.511 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -58.05 51.71 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.629 0 C-N-CA 125.881 1.672 . . . . 0.0 109.715 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.531 ' N ' ' O ' ' A' ' 69' ' ' SER . 96.8 p -56.94 -25.3 57.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 115.597 1.703 . . . . 0.0 115.597 -171.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.97 -46.57 78.58 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 118.573 0.624 . . . . 0.0 109.71 -178.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.61 -47.8 74.42 Favored 'General case' 0 C--N 1.352 0.714 0 CA-C-O 120.838 0.352 . . . . 0.0 110.587 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.601 HD11 ' HB3' ' A' ' 43' ' ' PHE . 3.2 tm? -60.91 -43.45 98.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.553 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' A' ' 29' ' ' ILE . 25.5 tp -57.24 -54.37 47.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.538 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.786 ' O ' ' HG3' ' A' ' 80' ' ' LYS . . . -58.41 -30.62 67.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.552 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -74.67 -58.73 3.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.563 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.98 -38.32 62.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.579 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -68.41 -35.15 77.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.563 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.786 ' HG3' ' O ' ' A' ' 76' ' ' ALA . 97.7 mttt -65.77 -36.79 84.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.526 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 84' ' ' ALA . 88.1 mt -74.56 -64.06 1.11 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.553 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.529 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 28.1 t30 -41.69 -26.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.566 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 81' ' ' LEU . 97.3 m-20 -90.72 -36.14 14.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.56 -27.6 45.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.596 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -102.47 25.26 9.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.547 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.84 162.32 21.03 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.573 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -69.59 152.45 70.18 Favored 'Trans proline' 0 N--CA 1.532 3.743 0 C-N-CA 122.092 1.861 . . . . 0.0 112.196 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.067 179.5 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 N-CA-C 109.97 -1.252 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.3 t -122.89 131.76 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -75.56 149.38 38.34 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.131 0.972 . . . . 0.0 110.502 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.409 HD21 ' ND2' ' A' ' 19' ' ' ASN . 62.1 t-20 -94.54 105.02 16.97 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.027 0.931 . . . . 0.0 110.438 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -63.63 -44.61 93.39 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.058 0.943 . . . . 0.0 112.627 -177.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.57 ' O ' ' CD2' ' A' ' 18' ' ' PHE . 50.8 p90 -176.34 99.96 0.06 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.398 -2.239 . . . . 0.0 105.523 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.409 ' ND2' HD21 ' A' ' 16' ' ' ASN . 55.4 p30 -95.2 -158.28 0.63 Allowed 'General case' 0 C--N 1.362 1.111 2 C-N-CA 107.663 -5.615 . . . . 0.0 110.606 -175.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.7 pttt -82.85 -49.31 9.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.61 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -51.22 -29.06 13.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.564 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.794 HE22 HD12 ' A' ' 47' ' ' LEU . 12.7 tp60 -81.62 -57.65 3.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.592 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -47.63 -39.38 16.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.549 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -59.77 -47.75 84.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.525 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 75' ' ' LEU . . . -69.05 -35.69 76.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.516 ' HB2' HE21 ' A' ' 22' ' ' GLN . 85.7 t80 -56.95 -37.67 71.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.585 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -70.44 -43.74 69.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.643 ' O ' HD13 ' A' ' 32' ' ' LEU . 45.4 tp10 -54.44 -44.22 72.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.528 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 96.6 mt -65.83 -28.98 45.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.61 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.8 tp -81.0 -5.89 58.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.577 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.435 ' O ' ' HD3' ' A' ' 33' ' ' PRO . 49.2 t-80 -97.99 -1.52 42.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.571 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.643 HD13 ' O ' ' A' ' 28' ' ' GLU . 1.8 mp -70.19 103.04 0.51 Allowed Pre-proline 0 CA--C 1.578 2.056 0 O-C-N 119.742 -1.848 . . . . 0.0 112.02 -177.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 31' ' ' HIS . 8.3 Cg_exo -71.8 154.65 58.8 Favored 'Trans proline' 0 N--CA 1.531 3.684 0 C-N-CA 122.935 2.423 . . . . 0.0 111.811 179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 58.37 36.68 25.65 Favored 'General case' 0 N--CA 1.498 1.935 0 CA-C-O 121.56 0.695 . . . . 0.0 109.661 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 32' ' ' LEU . 39.6 tp -100.73 129.8 46.68 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.944 -177.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -67.73 138.3 56.14 Favored 'General case' 0 CA--C 1.562 1.413 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -58.3 -46.84 85.35 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 127.619 2.368 . . . . 0.0 110.586 178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 56.5 mp0 -54.63 -42.34 71.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.622 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -69.45 -52.88 22.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.537 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -47.33 -52.96 14.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.548 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.419 ' O ' ' C ' ' A' ' 42' ' ' ALA . 96.9 m-20 -55.12 -66.44 0.41 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.545 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.49 -49.85 1.07 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.612 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 1.132 ' O ' HD23 ' A' ' 47' ' ' LEU . 40.7 m-85 -68.96 -46.02 69.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 5.1 mt -60.58 -38.67 79.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.56 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -62.64 -53.64 51.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.589 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 79.2 p -49.94 -34.15 19.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.573 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.132 HD23 ' O ' ' A' ' 43' ' ' PHE . 1.6 mm? -68.36 -12.06 60.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.584 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HZ2' ' HA ' ' A' ' 66' ' ' LEU . 63.4 tttp -105.28 -35.66 7.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.607 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -62.26 -8.82 6.36 Favored 'General case' 0 N--CA 1.515 2.823 0 N-CA-C 117.263 2.32 . . . . 0.0 117.263 -169.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -60.94 -43.8 98.16 Favored 'General case' 0 CA--C 1.593 2.633 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.9 p -156.0 158.0 37.13 Favored 'General case' 0 N--CA 1.538 3.942 0 CA-C-O 116.321 -1.8 . . . . 0.0 106.655 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . 0.261 99.4 m-85 -125.4 123.32 39.05 Favored 'General case' 2 N--CA 1.549 4.484 0 N-CA-C 121.198 3.777 . . . . 0.0 121.198 -173.418 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.455 ' O ' HG23 ' A' ' 53' ' ' ILE . 18.3 tt -144.93 119.37 3.12 Favored 'Isoleucine or valine' 1 C--N 1.473 5.959 3 CA-C-N 128.491 5.132 . . . . 0.0 111.282 -173.137 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.706 ' OD2' ' HA ' ' A' ' 57' ' ' ASN . 3.3 t0 -76.16 67.65 2.48 Favored 'General case' 0 C--N 1.374 1.651 0 O-C-N 119.021 -2.299 . . . . 0.0 111.967 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.413 ' OG1' ' ND2' ' A' ' 56' ' ' ASN . 14.3 p -46.65 -44.07 18.15 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 119.123 3.008 . . . . 0.0 119.123 177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.564 ' ND2' ' OE2' ' A' ' 65' ' ' GLU . 1.4 m120 -87.13 7.32 28.61 Favored 'General case' 0 N--CA 1.398 -3.045 0 N-CA-C 119.699 3.222 . . . . 0.0 119.699 -179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.706 ' HA ' ' OD2' ' A' ' 54' ' ' ASP . 1.3 t-20 52.24 52.54 14.08 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 110.565 -3.016 . . . . 0.0 114.824 177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -120.46 9.78 11.0 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 117.792 -1.563 . . . . 0.0 114.433 178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 88.67 -4.65 85.06 Favored Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 116.583 -2.722 . . . . 0.0 117.762 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -132.34 158.92 40.67 Favored 'General case' 0 N--CA 1.41 -2.467 0 O-C-N 122.032 -0.687 . . . . 0.0 112.498 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -108.06 117.16 33.42 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 100.656 -3.831 . . . . 0.0 100.656 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.938 ' OE2' ' OE1' ' A' ' 65' ' ' GLU . 0.0 OUTLIER -153.58 170.51 20.63 Favored 'General case' 0 C--N 1.363 1.19 0 C-N-CA 117.227 -1.789 . . . . 0.0 113.127 -179.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.46 ' O ' HD22 ' A' ' 66' ' ' LEU . . . 39.13 -119.36 0.96 Allowed Glycine 0 N--CA 1.429 -1.83 0 N-CA-C 119.519 2.567 . . . . 0.0 119.519 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -63.72 -8.14 9.54 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 116.9 -1.524 . . . . 0.0 112.132 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.938 ' OE1' ' OE2' ' A' ' 62' ' ' GLU . 3.1 mp0 -82.31 -9.0 59.64 Favored 'General case' 0 N--CA 1.428 -1.544 0 O-C-N 125.347 1.654 . . . . 0.0 110.16 177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.46 HD22 ' O ' ' A' ' 63' ' ' GLY 0.253 0.1 OUTLIER -77.15 -3.15 38.02 Favored 'General case' 1 CA--C 1.631 4.073 0 N-CA-C 120.221 3.415 . . . . 0.0 120.221 -173.639 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 4.9 m -85.88 153.34 22.3 Favored 'General case' 1 N--CA 1.577 5.899 0 CA-C-N 124.755 3.434 . . . . 0.0 116.062 -178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 47' ' ' LEU . . . -108.59 -132.54 6.68 Favored Glycine 2 N--CA 1.528 4.796 0 O-C-N 120.955 -1.091 . . . . 0.0 113.967 -179.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.445 ' C ' ' H ' ' A' ' 71' ' ' SER . 83.3 p -149.45 -50.78 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.551 0.741 . . . . 0.0 111.052 -178.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -73.14 33.96 0.07 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 124.31 1.044 . . . . 0.0 110.406 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.501 ' OG ' ' HA ' ' A' ' 22' ' ' GLN . 86.0 p -63.97 -30.36 71.44 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 116.864 2.172 . . . . 0.0 116.864 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -55.91 -44.51 78.35 Favored 'General case' 0 C--O 1.251 1.181 0 CA-C-N 117.772 0.26 . . . . 0.0 110.727 -173.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -65.71 -47.8 74.15 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 120.812 0.339 . . . . 0.0 110.547 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB3' HD21 ' A' ' 47' ' ' LEU . 4.1 mm? -60.9 -43.45 98.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.539 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 23.7 tp -57.24 -54.4 47.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.521 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.4 -30.64 67.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.519 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -74.66 -58.76 3.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.56 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -52.94 -38.31 61.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.582 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -68.46 -35.12 77.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.552 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -65.75 -36.77 84.52 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.585 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.472 ' O ' ' N ' ' A' ' 84' ' ' ALA . 34.9 tp -74.6 -64.08 1.11 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.56 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 86' ' ' ALA . 38.7 t30 -41.65 -26.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.58 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 81' ' ' LEU . 88.4 m-20 -90.77 -36.09 14.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.531 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.472 ' N ' ' O ' ' A' ' 81' ' ' LEU . . . -78.57 -27.55 45.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.624 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -102.5 25.28 9.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.519 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 82' ' ' ASN . . . -100.86 162.01 22.0 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.535 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -61.98 145.99 96.51 Favored 'Trans proline' 0 N--CA 1.532 3.792 0 C-N-CA 121.755 1.637 . . . . 0.0 112.132 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 118.329 -0.843 . . . . 0.0 110.287 179.912 . . . . . . . . 0 0 . 1 stop_ save_